N,4-bis(5-chloranyl-2-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: N,4-bis(5-chloranyl-2-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: N,4-bis(5-chloro-2-methyl-phenyl)piperazine-1-carbothioamide CAS Name: N,4-bis(5-chloro-2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: N,4-bis(5-chloro-2-methylphenyl)piperazine-1-carbothioamide Traditional Name: N,4-bis(5-chloro-2-methyl-phenyl)piperazine-1-carbothioamide Formula: C19H21Cl2N3S MolecularWeight: 394.36114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21Cl2N3S/c1-13-3-5-15(20)11-17(13)22-19(25)24-9-7-23(8-10-24)18-12-16(21)6-4-14(18)2/h3-6,11-12H,7-10H2,1-2H3,(H,22,25)