N-[1-[3-[2-(iminomethyl)-4-methylsulfanyl-phenyl]-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-2-oxidanylidene-pyrrolidin-3-yl]-6,7-dimethoxy-naphthalene-2-sulfonamide

Systemtic Name: N-[1-[3-[2-(iminomethyl)-4-methylsulfanyl-phenyl]-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-2-oxidanylidene-pyrrolidin-3-yl]-6,7-dimethoxy-naphthalene-2-sulfonamide Openeye Name: N-[1-[1-[(2-methanimidoyl-4-methylsulfanyl-phenyl)methyl]-2-oxo-2-(1-piperidyl)ethyl]-2-oxo-pyrrolidin-3-yl]-6,7-dimethoxy-naphthalene-2-sulfonamide CAS Name: N-[1-[3-[2-methanimidoyl-4-(methylthio)phenyl]-1-oxo-1-(1-piperidinyl)propan-2-yl]-2-oxo-3-pyrrolidinyl]-6,7-dimethoxy-2-naphthalenesulfonamide IUPAC Name: N-[1-[3-(2-methanimidoyl-4-methylsulfanylphenyl)-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-oxopyrrolidin-3-yl]-6,7-dimethoxynaphthalene-2-sulfonamide Traditional Name: N-[1-[1-[2-formimidoyl-4-(methylthio)benzyl]-2-keto-2-piperidino-ethyl]-2-keto-pyrrolidin-3-yl]-6,7-dimethoxy-naphthalene-2-sulfonamide Formula: C32H38N4O6S2 MolecularWeight: 638.79732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)NC3CCN(C3=O)C(CC4=C(C=C(C=C4)SC)C=N)C(=O)N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)NC3CCN(C3=O)C(CC4=C(C=C(C=C4)SC)C=N)C(=O)N5CCCCC5)OC

InChI

InChI=1S/C32H38N4O6S2/c1-41-29-18-22-8-10-26(16-23(22)19-30(29)42-2)44(39,40)34-27-11-14-36(31(27)37)28(32(38)35-12-5-4-6-13-35)17-21-7-9-25(43-3)15-24(21)20-33/h7-10,15-16,18-20,27-28,33-34H,4-6,11-14,17H2,1-3H3