N-(3,4-dimethylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide CAS Name: N-(3,4-dimethylphenyl)-4-(1-phenylethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Traditional Name: N-(3,4-dimethylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Formula: C21H27N3S MolecularWeight: 353.52418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H27N3S/c1-16-9-10-20(15-17(16)2)22-21(25)24-13-11-23(12-14-24)18(3)19-7-5-4-6-8-19/h4-10,15,18H,11-14H2,1-3H3,(H,22,25)