(2S)-N-[(2S)-1-[[2-[[2-[[(2S)-6-[5-[(3aS,4S,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-1-azanyl-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-[4-methyl-2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]pentanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-[[2-[[2-[[(2S)-6-[5-[(3aS,4S,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-1-azanyl-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-[4-methyl-2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]pentanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-[[2-[[2-[[(1S)-5-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-1-carbamoyl-pentyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]-1-[2-[2-(hydroxyamino)-2-oxo-ethyl]-4-methyl-pentanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-[[2-[[2-[[(2S)-6-[[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-1-oxopentyl]amino]-1-amino-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-1-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methyl-1-oxopentyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-[[2-[[2-[[(2S)-6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-1-amino-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-1-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-[[2-[[2-[[(1S)-5-[5-[(3aS,4S,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]pentanoylamino]-1-carbamoyl-pentyl]amino]-2-keto-ethyl]amino]-2-keto-ethyl]carbamoyl]-3-methyl-butyl]-1-[2-[2-(hydroxyamino)-2-keto-ethyl]-4-methyl-pentanoyl]pyrrolidine-2-carboxamide Formula: C39H66N10O10S MolecularWeight: 867.06734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)NO)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NCC(=O)NCC(=O)NC(CCCCNC(=O)CCCCC2C3C(CS2)NC(=O)N3)C(=O)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2)C(=O)N)NC(=O)[C@@H]3CCCN3C(=O)C(CC(C)C)CC(=O)NO

InChI

InChI=1S/C39H66N10O10S/c1-22(2)16-24(18-31(51)48-59)38(57)49-15-9-11-28(49)37(56)45-26(17-23(3)4)36(55)43-19-32(52)42-20-33(53)44-25(35(40)54)10-7-8-14-41-30(50)13-6-5-12-29-34-27(21-60-29)46-39(58)47-34/h22-29,34,59H,5-21H2,1-4H3,(H2,40,54)(H,41,50)(H,42,52)(H,43,55)(H,44,53)(H,45,56)(H,48,51)(H2,46,47,58)/t24?,25-,26-,27-,28-,29-,34-/m0/s1