N-(2-chloranyl-4-methyl-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-chloro-4-methylphenyl)-4-(6-methyl-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-chloro-4-methylphenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide Formula: C18H21ClN4S MolecularWeight: 360.90414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=N3)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC(=N3)C)Cl

InChI

InChI=1S/C18H21ClN4S/c1-13-6-7-16(15(19)12-13)21-18(24)23-10-8-22(9-11-23)17-5-3-4-14(2)20-17/h3-7,12H,8-11H2,1-2H3,(H,21,24)