N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide CAS Name: N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methyl-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methylpiperazine-1-carbothioamide Traditional Name: N-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=S)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=S)NC3=CC(=C(C=C3)C)C

InChI

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