N-[4-(3-methoxyphenyl)piperazin-1-yl]carbothioyl-3-phenyl-prop-2-enamide

Systemtic Name: N-[4-(3-methoxyphenyl)piperazin-1-yl]carbothioyl-3-phenyl-prop-2-enamide Openeye Name: N-[4-(3-methoxyphenyl)piperazine-1-carbothioyl]-3-phenyl-prop-2-enamide CAS Name: N-[[4-(3-methoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: N-[4-(3-methoxyphenyl)piperazine-1-carbothioyl]-3-phenylprop-2-enamide Traditional Name: N-[4-(3-methoxyphenyl)piperazine-1-carbothioyl]-3-phenyl-acrylamide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2S/c1-26-19-9-5-8-18(16-19)23-12-14-24(15-13-23)21(27)22-20(25)11-10-17-6-3-2-4-7-17/h2-11,16H,12-15H2,1H3,(H,22,25,27)