N-(2,6-diethylphenyl)-3-methyl-4-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,6-diethylphenyl)-3-methyl-4-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: N-(2,6-diethylphenyl)-3-methyl-4-(m-tolyl)piperazine-1-carbothioamide CAS Name: N-(2,6-diethylphenyl)-3-methyl-4-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,6-diethylphenyl)-3-methyl-4-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: N-(2,6-diethylphenyl)-3-methyl-4-(m-tolyl)piperazine-1-carbothioamide Formula: C23H31N3S MolecularWeight: 381.57734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(C(C2)C)C3=CC=CC(=C3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(C(C2)C)C3=CC=CC(=C3)C

InChI

InChI=1S/C23H31N3S/c1-5-19-10-8-11-20(6-2)22(19)24-23(27)25-13-14-26(18(4)16-25)21-12-7-9-17(3)15-21/h7-12,15,18H,5-6,13-14,16H2,1-4H3,(H,24,27)