N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: N-(3,5-dimethoxyphenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H27N3O2S/c1-15-6-5-7-20(16(15)2)23-8-10-24(11-9-23)21(27)22-17-12-18(25-3)14-19(13-17)26-4/h5-7,12-14H,8-11H2,1-4H3,(H,22,27)