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

Systemtic Name: N-[3-[4-(diethylaminomethyl)phenyl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]-3-phenyl-3-(quinolin-2-ylsulfonylamino)propanamide Openeye Name: N-[1-[[4-(diethylaminomethyl)phenyl]methyl]-2-oxo-2-pyrrolidin-1-yl-ethyl]-3-phenyl-3-(2-quinolylsulfonylamino)propanamide CAS Name: N-[3-[4-(diethylaminomethyl)phenyl]-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]-3-phenyl-3-(2-quinolinylsulfonylamino)propanamide IUPAC Name: N-[3-[4-(diethylaminomethyl)phenyl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-3-phenyl-3-(quinolin-2-ylsulfonylamino)propanamide Traditional Name: N-[1-[4-(diethylaminomethyl)benzyl]-2-keto-2-pyrrolidino-ethyl]-3-phenyl-3-(2-quinolylsulfonylamino)propionamide Formula: C36H43N5O4S MolecularWeight: 641.82272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CC(C(=O)N2CCCC2)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CC(C(=O)N2CCCC2)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C36H43N5O4S/c1-3-40(4-2)26-28-18-16-27(17-19-28)24-33(36(43)41-22-10-11-23-41)37-34(42)25-32(29-12-6-5-7-13-29)39-46(44,45)35-21-20-30-14-8-9-15-31(30)38-35/h5-9,12-21,32-33,39H,3-4,10-11,22-26H2,1-2H3,(H,37,42)