N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[3-[4-(m-tolyl)piperazino]propyl]-4-(2-thienyl)butyramide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H29N3O2S/c1-18-5-2-6-19(17-18)25-14-12-24(13-15-25)11-4-10-23-22(27)9-8-20(26)21-7-3-16-28-21/h2-3,5-7,16-17H,4,8-15H2,1H3,(H,23,27)