N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-(phenylmethyl)naphthalene-2-sulfonamide

Systemtic Name: N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-(phenylmethyl)naphthalene-2-sulfonamide Openeye Name: N-benzyl-N-[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-oxo-pyrrolidin-3-yl]-7-methoxy-naphthalene-2-sulfonamide CAS Name: N-[(3S)-1-[(5-cyano-3-thiophenyl)methyl]-2-oxo-3-pyrrolidinyl]-7-methoxy-N-(phenylmethyl)-2-naphthalenesulfonamide IUPAC Name: N-benzyl-N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxopyrrolidin-3-yl]-7-methoxynaphthalene-2-sulfonamide Traditional Name: N-benzyl-N-[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-keto-pyrrolidin-3-yl]-7-methoxy-naphthalene-2-sulfonamide Formula: C28H25N3O4S2 MolecularWeight: 531.6458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4CCN(C4=O)CC5=CSC(=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=C3)[C@H]4CCN(C4=O)CC5=CSC(=C5)C#N

InChI

InChI=1S/C28H25N3O4S2/c1-35-24-9-7-22-8-10-26(15-23(22)14-24)37(33,34)31(18-20-5-3-2-4-6-20)27-11-12-30(28(27)32)17-21-13-25(16-29)36-19-21/h2-10,13-15,19,27H,11-12,17-18H2,1H3/t27-/m0/s1