N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-(thiophen-3-ylmethyl)naphthalene-2-sulfonamide

Systemtic Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-(thiophen-3-ylmethyl)naphthalene-2-sulfonamide Openeye Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-pyrrolidin-3-yl]-7-methoxy-N-(3-thienylmethyl)naphthalene-2-sulfonamide CAS Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-3-pyrrolidinyl]-7-methoxy-N-(3-thiophenylmethyl)-2-naphthalenesulfonamide IUPAC Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxopyrrolidin-3-yl]-7-methoxy-N-(thiophen-3-ylmethyl)naphthalene-2-sulfonamide Traditional Name: N-[(3S)-1-(3-cyanobenzyl)-2-keto-pyrrolidin-3-yl]-7-methoxy-N-(3-thenyl)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=CSC=C3)C4CCN(C4=O)CC5=CC=CC(=C5)C#N

Isomeric SMILES

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

InChI

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