2-[[(3S)-1-[(3-carbamimidoylphenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(4-phenylphenyl)sulfonyl-amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[[(3S)-1-[(3-carbamimidoylphenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-(4-phenylphenyl)sulfonyl-amino]-N-phenethyl-ethanamide Openeye Name: 2-[[(3S)-1-[(3-carbamimidoylphenyl)methyl]-2-oxo-pyrrolidin-3-yl]-(4-phenylphenyl)sulfonyl-amino]-N-phenethyl-acetamide CAS Name: 2-[[(3S)-1-[(3-carbamimidoylphenyl)methyl]-2-oxo-3-pyrrolidinyl]-(4-phenylphenyl)sulfonylamino]-N-phenethylacetamide IUPAC Name: 2-[[(3S)-1-[(3-carbamimidoylphenyl)methyl]-2-oxopyrrolidin-3-yl]-(4-phenylphenyl)sulfonylamino]-N-phenethylacetamide Traditional Name: 2-[[(3S)-1-(3-amidinobenzyl)-2-keto-pyrrolidin-3-yl]-(4-phenylphenyl)sulfonyl-amino]-N-phenethyl-acetamide Formula: C34H35N5O4S MolecularWeight: 609.7378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1N(CC(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CC5=CC=CC(=C5)C(=N)N

Isomeric SMILES

C1CN(C(=O)[C@H]1N(CC(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CC5=CC=CC(=C5)C(=N)N

InChI

InChI=1S/C34H35N5O4S/c35-33(36)29-13-7-10-26(22-29)23-38-21-19-31(34(38)41)39(24-32(40)37-20-18-25-8-3-1-4-9-25)44(42,43)30-16-14-28(15-17-30)27-11-5-2-6-12-27/h1-17,22,31H,18-21,23-24H2,(H3,35,36)(H,37,40)/t31-/m0/s1