N-(2,4-dimethoxyphenyl)-4-[(3-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-4-[(3-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(2,4-dimethoxyphenyl)-4-(m-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(2,4-dimethoxyphenyl)-4-[(3-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(2,4-dimethoxyphenyl)-4-[(3-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(2,4-dimethoxyphenyl)-4-(3-methylbenzyl)piperazine-1-carbothioamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O2S/c1-16-5-4-6-17(13-16)15-23-9-11-24(12-10-23)21(27)22-19-8-7-18(25-2)14-20(19)26-3/h4-8,13-14H,9-12,15H2,1-3H3,(H,22,27)