N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-(6-methyl-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3OC)Cl)OC

Isomeric SMILES

CC1=NC(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3OC)Cl)OC

InChI

InChI=1S/C19H23ClN4O2S/c1-13-5-4-6-18(21-13)23-7-9-24(10-8-23)19(27)22-15-12-16(25-2)14(20)11-17(15)26-3/h4-6,11-12H,7-10H2,1-3H3,(H,22,27)