4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(diphenylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(diphenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzhydryl-4-(3,5-dichloro-4-pyridyl)piperazine-1-carbothioamide CAS Name: 4-(3,5-dichloro-4-pyridinyl)-N-(diphenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzhydryl-4-(3,5-dichloropyridin-4-yl)piperazine-1-carbothioamide Traditional Name: N-benzhydryl-4-(3,5-dichloro-4-pyridyl)piperazine-1-carbothioamide Formula: C23H22Cl2N4S MolecularWeight: 457.41858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22Cl2N4S/c24-19-15-26-16-20(25)22(19)28-11-13-29(14-12-28)23(30)27-21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,15-16,21H,11-14H2,(H,27,30)