2,2-diphenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]propanamide

Systemtic Name: 2,2-diphenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]propanamide Openeye Name: 2,2-diphenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]propanamide CAS Name: 2,2-diphenyl-N-[[4-(1-pyrrolidinylmethyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-diphenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]propanamide Traditional Name: 2,2-diphenyl-N-[[4-(pyrrolidinomethyl)phenyl]thiocarbamoyl]propionamide Formula: C27H29N3OS MolecularWeight: 443.60366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC=C(C=C3)CN4CCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC=C(C=C3)CN4CCCC4

InChI

InChI=1S/C27H29N3OS/c1-27(22-10-4-2-5-11-22,23-12-6-3-7-13-23)25(31)29-26(32)28-24-16-14-21(15-17-24)20-30-18-8-9-19-30/h2-7,10-17H,8-9,18-20H2,1H3,(H2,28,29,31,32)