2-[[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonyl-amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonyl-amino]-N-phenethyl-ethanamide Openeye Name: 2-[[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-oxo-pyrrolidin-3-yl]-[(7-methoxy-2-naphthyl)sulfonyl]amino]-N-phenethyl-acetamide CAS Name: 2-[[(3S)-1-[(5-cyano-3-thiophenyl)methyl]-2-oxo-3-pyrrolidinyl]-[(7-methoxy-2-naphthalenyl)sulfonyl]amino]-N-phenethylacetamide IUPAC Name: 2-[[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxopyrrolidin-3-yl]-(7-methoxynaphthalen-2-yl)sulfonylamino]-N-phenethylacetamide Traditional Name: 2-[[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-keto-pyrrolidin-3-yl]-[(7-methoxy-2-naphthyl)sulfonyl]amino]-N-phenethyl-acetamide Formula: C31H30N4O5S2 MolecularWeight: 602.7237

Click to see the large picture

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=CSC(=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=CSC(=C5)C#N

InChI

InChI=1S/C31H30N4O5S2/c1-40-26-9-7-24-8-10-28(17-25(24)16-26)42(38,39)35(20-30(36)33-13-11-22-5-3-2-4-6-22)29-12-14-34(31(29)37)19-23-15-27(18-32)41-21-23/h2-10,15-17,21,29H,11-14,19-20H2,1H3,(H,33,36)/t29-/m0/s1