2-[[(3S)-1-[(2-cyanopyridin-4-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonyl-amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[[(3S)-1-[(2-cyanopyridin-4-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonyl-amino]-N-phenethyl-ethanamide Openeye Name: 2-[[(3S)-1-[(2-cyano-4-pyridyl)methyl]-2-oxo-pyrrolidin-3-yl]-[(7-methoxy-2-naphthyl)sulfonyl]amino]-N-phenethyl-acetamide CAS Name: 2-[[(3S)-1-[(2-cyano-4-pyridinyl)methyl]-2-oxo-3-pyrrolidinyl]-[(7-methoxy-2-naphthalenyl)sulfonyl]amino]-N-phenethylacetamide IUPAC Name: 2-[[(3S)-1-[(2-cyanopyridin-4-yl)methyl]-2-oxopyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonylamino]-N-phenethylacetamide Traditional Name: 2-[[(3S)-1-[(2-cyano-4-pyridyl)methyl]-2-keto-pyrrolidin-3-yl]-[(7-methoxy-2-naphthyl)sulfonyl]amino]-N-phenethyl-acetamide Formula: C32H31N5O5S MolecularWeight: 597.68404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC(=O)NCCC3=CC=CC=C3)C4CCN(C4=O)CC5=CC(=NC=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC(=O)NCCC3=CC=CC=C3)[C@H]4CCN(C4=O)CC5=CC(=NC=C5)C#N

InChI

InChI=1S/C32H31N5O5S/c1-42-28-9-7-25-8-10-29(19-26(25)18-28)43(40,41)37(22-31(38)35-15-11-23-5-3-2-4-6-23)30-13-16-36(32(30)39)21-24-12-14-34-27(17-24)20-33/h2-10,12,14,17-19,30H,11,13,15-16,21-22H2,1H3,(H,35,38)/t30-/m0/s1