N-(4-bromanyl-2-chloranyl-phenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-bromo-2-chlorophenyl)-4-(2,3-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide Formula: C19H21BrClN3S MolecularWeight: 438.81214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrClN3S/c1-13-4-3-5-18(14(13)2)23-8-10-24(11-9-23)19(25)22-17-7-6-15(20)12-16(17)21/h3-7,12H,8-11H2,1-2H3,(H,22,25)