N-[3-[4-(aminomethyl)phenyl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]-3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide

Systemtic Name: N-[3-[4-(aminomethyl)phenyl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]-3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide Openeye Name: N-[1-[[4-(aminomethyl)phenyl]methyl]-2-oxo-2-pyrrolidin-1-yl-ethyl]-3-(2-naphthylsulfonylamino)-3-phenyl-propanamide CAS Name: N-[3-[4-(aminomethyl)phenyl]-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]-3-(2-naphthalenylsulfonylamino)-3-phenylpropanamide IUPAC Name: N-[3-[4-(aminomethyl)phenyl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-3-(naphthalen-2-ylsulfonylamino)-3-phenylpropanamide Traditional Name: N-[1-[4-(aminomethyl)benzyl]-2-keto-2-pyrrolidino-ethyl]-3-(2-naphthylsulfonylamino)-3-phenyl-propionamide Formula: C33H36N4O4S MolecularWeight: 584.72834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(CC2=CC=C(C=C2)CN)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)C(=O)C(CC2=CC=C(C=C2)CN)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C33H36N4O4S/c34-23-25-14-12-24(13-15-25)20-31(33(39)37-18-6-7-19-37)35-32(38)22-30(27-9-2-1-3-10-27)36-42(40,41)29-17-16-26-8-4-5-11-28(26)21-29/h1-5,8-17,21,30-31,36H,6-7,18-20,22-23,34H2,(H,35,38)