N-[(2S,3S)-1-[[1-[[(2S)-1-[[(2S)-1-[[(2S)-1-(ethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentan-2-yl]amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide

Systemtic Name: N-[(2S,3S)-1-[[1-[[(2S)-1-[[(2S)-1-[[(2S)-1-(ethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentan-2-yl]amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide Openeye Name: N-[(1S,2S)-1-[[1-[[(1S)-1-[[[(1S)-2-[[(1S)-1-(ethylcarbamoyl)-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]methyl]-3-methyl-butyl]carbamoyl]-3-methylsulfonyl-propyl]carbamoyl]-2-methyl-butyl]-1-oxido-pyridin-1-ium-4-carboxamide CAS Name: N-[(2S,3S)-1-[[1-[[(2S)-1-[[(2S)-1-[[(2S)-1-(ethylamino)-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methylpentan-2-yl]amino]-4-methylsulfonyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-1-oxido-4-pyridin-1-iumcarboxamide IUPAC Name: N-[(2S,3S)-1-[[1-[[(2S)-1-[[(2S)-1-[[(2S)-1-(ethylamino)-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methylpentan-2-yl]amino]-4-methylsulfonyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]-1-oxidopyridin-1-ium-4-carboxamide Traditional Name: N-[(1S,2S)-1-[[1-[[(1S)-1-[[[(1S)-2-[[(1S)-1-(ethylcarbamoyl)-2-methyl-propyl]amino]-2-keto-1-methyl-ethyl]amino]methyl]-3-methyl-butyl]carbamoyl]-3-mesyl-propyl]carbamoyl]-2-methyl-butyl]-1-oxido-pyridin-1-ium-4-carboxamide Formula: C33H57N7O8S MolecularWeight: 711.91278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCS(=O)(=O)C)C(=O)NC(CC(C)C)CNC(C)C(=O)NC(C(C)C)C(=O)NCC)NC(=O)C1=CC=[N+](C=C1)[O-]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC(CCS(=O)(=O)C)C(=O)N[C@@H](CC(C)C)CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCC)NC(=O)C1=CC=[N+](C=C1)[O-]

InChI

InChI=1S/C33H57N7O8S/c1-10-22(7)28(39-30(42)24-12-15-40(46)16-13-24)33(45)37-26(14-17-49(9,47)48)31(43)36-25(18-20(3)4)19-35-23(8)29(41)38-27(21(5)6)32(44)34-11-2/h12-13,15-16,20-23,25-28,35H,10-11,14,17-19H2,1-9H3,(H,34,44)(H,36,43)(H,37,45)(H,38,41)(H,39,42)/t22-,23-,25-,26?,27-,28-/m0/s1