4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(2-phenylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(2-phenylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(3,5-dichloro-4-pyridyl)-N-(2-phenylphenyl)piperazine-1-carbothioamide CAS Name: 4-(3,5-dichloro-4-pyridinyl)-N-(2-phenylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3,5-dichloropyridin-4-yl)-N-(2-phenylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3,5-dichloro-4-pyridyl)-N-(2-phenylphenyl)piperazine-1-carbothioamide Formula: C22H20Cl2N4S MolecularWeight: 443.392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C22H20Cl2N4S/c23-18-14-25-15-19(24)21(18)27-10-12-28(13-11-27)22(29)26-20-9-5-4-8-17(20)16-6-2-1-3-7-16/h1-9,14-15H,10-13H2,(H,26,29)