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

Systemtic Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-(thiophen-2-ylmethyl)naphthalene-2-sulfonamide Openeye Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-pyrrolidin-3-yl]-7-methoxy-N-(2-thienylmethyl)naphthalene-2-sulfonamide CAS Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-3-pyrrolidinyl]-7-methoxy-N-(thiophen-2-ylmethyl)-2-naphthalenesulfonamide IUPAC Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxopyrrolidin-3-yl]-7-methoxy-N-(thiophen-2-ylmethyl)naphthalene-2-sulfonamide Traditional Name: N-[(3S)-1-(3-cyanobenzyl)-2-keto-pyrrolidin-3-yl]-7-methoxy-N-(2-thenyl)naphthalene-2-sulfonamide Formula: C28H25N3O4S2 MolecularWeight: 531.6458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CS3)C4CCN(C4=O)CC5=CC=CC(=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CS3)[C@H]4CCN(C4=O)CC5=CC=CC(=C5)C#N

InChI

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