(2S)-N-[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]-1-[(2S)-1-[4-methyl-2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]pentanoyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[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]-1-[(2S)-1-[4-methyl-2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]pentanoyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[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]-1-[(2S)-1-[2-[2-(hydroxyamino)-2-oxo-ethyl]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[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]-1-[[(2S)-1-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methyl-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[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]-1-[(2S)-1-[2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[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]-1-[(2S)-1-[2-[2-(hydroxyamino)-2-keto-ethyl]-4-methyl-pentanoyl]prolyl]pyrrolidine-2-carboxamide Formula: C38H62N10O10S MolecularWeight: 851.02488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)NO)C(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCC(=O)NCC(=O)NC(CCCCNC(=O)CCCCC3C4C(CS3)NC(=O)N4)C(=O)N

Isomeric SMILES

CC(C)CC(CC(=O)NO)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4)C(=O)N

InChI

InChI=1S/C38H62N10O10S/c1-22(2)17-23(18-30(50)46-58)36(55)48-16-8-11-27(48)37(56)47-15-7-10-26(47)35(54)42-19-31(51)41-20-32(52)43-24(34(39)53)9-5-6-14-40-29(49)13-4-3-12-28-33-25(21-59-28)44-38(57)45-33/h22-28,33,58H,3-21H2,1-2H3,(H2,39,53)(H,40,49)(H,41,51)(H,42,54)(H,43,52)(H,46,50)(H2,44,45,57)/t23?,24-,25-,26-,27-,28-,33-/m0/s1