4-(2,5-dimethylthiophen-3-yl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-oxidanylidene-butanamide Openeye Name: 4-(2,5-dimethyl-3-thienyl)-N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]-4-oxo-butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]-4-oxobutanamide IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-oxobutanamide Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-N-[4-[4-(m-tolyl)piperazino]butyl]butyramide Formula: C25H35N3O2S MolecularWeight: 441.6293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)CCC(=O)C3=C(SC(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)CCC(=O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C25H35N3O2S/c1-19-7-6-8-22(17-19)28-15-13-27(14-16-28)12-5-4-11-26-25(30)10-9-24(29)23-18-20(2)31-21(23)3/h6-8,17-18H,4-5,9-16H2,1-3H3,(H,26,30)