2-(2-chlorophenyl)-3-(4-chlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carbothioamide

Systemtic Name: 2-(2-chlorophenyl)-3-(4-chlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carbothioamide Openeye Name: 2-(2-chlorophenyl)-3-(4-chlorophenyl)-N-(1-piperidyl)-3,4-dihydropyrazole-5-carbothioamide CAS Name: 2-(2-chlorophenyl)-3-(4-chlorophenyl)-N-(1-piperidinyl)-3,4-dihydropyrazole-5-carbothioamide IUPAC Name: 2-(2-chlorophenyl)-3-(4-chlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carbothioamide Traditional Name: 1-(2-chlorophenyl)-5-(4-chlorophenyl)-N-piperidino-2-pyrazoline-3-carbothioamide Formula: C21H22Cl2N4S MolecularWeight: 433.39718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC(=S)C2=NN(C(C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)NC(=S)C2=NN(C(C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H22Cl2N4S/c22-16-10-8-15(9-11-16)20-14-18(21(28)25-26-12-4-1-5-13-26)24-27(20)19-7-3-2-6-17(19)23/h2-3,6-11,20H,1,4-5,12-14H2,(H,25,28)