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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide Openeye Name: 4-benzhydryl-N-(3-chloro-2-methyl-phenyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-4-(diphenylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-benzhydryl-N-(3-chloro-2-methyl-phenyl)piperazine-1-carbothioamide Formula: C25H26ClN3S MolecularWeight: 436.01204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3S/c1-19-22(26)13-8-14-23(19)27-25(30)29-17-15-28(16-18-29)24(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-14,24H,15-18H2,1H3,(H,27,30)