N-[3-heptan-4-ylsulfonyl-1-[[4-(2-methoxyethylsulfanyl)-5-(2-methylpropylamino)-3-oxidanyl-5-oxidanylidene-1-phenyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[3-heptan-4-ylsulfonyl-1-[[4-(2-methoxyethylsulfanyl)-5-(2-methylpropylamino)-3-oxidanyl-5-oxidanylidene-1-phenyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[2-[[1-benzyl-2-hydroxy-4-(isobutylamino)-3-(2-methoxyethylsulfanyl)-4-oxo-butyl]amino]-2-oxo-1-(1-propylbutylsulfonylmethyl)ethyl]pyridine-3-carboxamide CAS Name: N-[3-heptan-4-ylsulfonyl-1-[[3-hydroxy-4-(2-methoxyethylthio)-5-(2-methylpropylamino)-5-oxo-1-phenylpentan-2-yl]amino]-1-oxopropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[3-heptan-4-ylsulfonyl-1-[[3-hydroxy-4-(2-methoxyethylsulfanyl)-5-(2-methylpropylamino)-5-oxo-1-phenylpentan-2-yl]amino]-1-oxopropan-2-yl]pyridine-3-carboxamide Traditional Name: N-[2-[[1-benzyl-2-hydroxy-4-(isobutylamino)-4-keto-3-(2-methoxyethylthio)butyl]amino]-2-keto-1-(1-propylbutylsulfonylmethyl)ethyl]nicotinamide Formula: C34H52N4O7S2 MolecularWeight: 692.92928

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(C(C(=O)NCC(C)C)SCCOC)O)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(C(C(=O)NCC(C)C)SCCOC)O)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C34H52N4O7S2/c1-6-12-27(13-7-2)47(43,44)23-29(38-32(40)26-16-11-17-35-22-26)33(41)37-28(20-25-14-9-8-10-15-25)30(39)31(46-19-18-45-5)34(42)36-21-24(3)4/h8-11,14-17,22,24,27-31,39H,6-7,12-13,18-21,23H2,1-5H3,(H,36,42)(H,37,41)(H,38,40)