N-(3-cyanothiophen-2-yl)-3-[4-(diphenylmethyl)piperazin-1-yl]propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[4-(diphenylmethyl)piperazin-1-yl]propanamide Openeye Name: 3-(4-benzhydrylpiperazin-1-yl)-N-(3-cyano-2-thienyl)propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[4-(diphenylmethyl)-1-piperazinyl]propanamide IUPAC Name: 3-(4-benzhydrylpiperazin-1-yl)-N-(3-cyanothiophen-2-yl)propanamide Traditional Name: 3-(4-benzhydrylpiperazino)-N-(3-cyano-2-thienyl)propionamide Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4OS/c26-19-22-12-18-31-25(22)27-23(30)11-13-28-14-16-29(17-15-28)24(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-10,12,18,24H,11,13-17H2,(H,27,30)