N-(3-chloranyl-2-methyl-phenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-(4-pyridylmethyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-4-(pyridin-4-ylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-(4-pyridylmethyl)piperazine-1-carbothioamide Formula: C18H21ClN4S MolecularWeight: 360.90414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H21ClN4S/c1-14-16(19)3-2-4-17(14)21-18(24)23-11-9-22(10-12-23)13-15-5-7-20-8-6-15/h2-8H,9-13H2,1H3,(H,21,24)