4-(3,5-dimethylphenyl)-N-(5-ethanoyl-2-methoxy-6-methyl-pyridin-3-yl)piperazine-1-carbothioamide

Systemtic Name: 4-(3,5-dimethylphenyl)-N-(5-ethanoyl-2-methoxy-6-methyl-pyridin-3-yl)piperazine-1-carbothioamide Openeye Name: N-(5-acetyl-2-methoxy-6-methyl-3-pyridyl)-4-(3,5-dimethylphenyl)piperazine-1-carbothioamide CAS Name: N-(5-acetyl-2-methoxy-6-methyl-3-pyridinyl)-4-(3,5-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(5-acetyl-2-methoxy-6-methylpyridin-3-yl)-4-(3,5-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: N-(5-acetyl-2-methoxy-6-methyl-3-pyridyl)-4-(3,5-dimethylphenyl)piperazine-1-carbothioamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O2S/c1-14-10-15(2)12-18(11-14)25-6-8-26(9-7-25)22(29)24-20-13-19(17(4)27)16(3)23-21(20)28-5/h10-13H,6-9H2,1-5H3,(H,24,29)