N-(2-ethoxyphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-ethoxyphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Openeye Name: N-(2-ethoxyphenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide CAS Name: N-(2-ethoxyphenyl)-3-methyl-4-(4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-ethoxyphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Traditional Name: 3-methyl-N-o-phenetyl-4-(p-tolyl)piperazine-1-carbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2CCN(C(C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2CCN(C(C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H27N3OS/c1-4-25-20-8-6-5-7-19(20)22-21(26)23-13-14-24(17(3)15-23)18-11-9-16(2)10-12-18/h5-12,17H,4,13-15H2,1-3H3,(H,22,26)