N-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: N-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-(4-chlorophenyl)-5-phenyl-2-pyrazoline-1-carbothioamide Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C=NN(C1C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3S/c17-13-6-8-14(9-7-13)19-16(21)20-15(10-11-18-20)12-4-2-1-3-5-12/h1-9,11,15H,10H2,(H,19,21)