N-(3-chloranyl-4-fluoranyl-phenyl)-4-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(m-tolyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(m-tolyl)piperazine-1-carbothioamide Formula: C18H19ClFN3S MolecularWeight: 363.879963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H19ClFN3S/c1-13-3-2-4-15(11-13)22-7-9-23(10-8-22)18(24)21-14-5-6-17(20)16(19)12-14/h2-6,11-12H,7-10H2,1H3,(H,21,24)