5-(4-chlorophenyl)-3-phenyl-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-chlorophenyl)-3-phenyl-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-benzyl-5-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-chlorophenyl)-3-phenyl-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-benzyl-5-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-benzyl-3-(4-chlorophenyl)-5-phenyl-2-pyrazoline-1-carbothioamide Formula: C23H20ClN3S MolecularWeight: 405.943

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=S)NCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=S)NCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20ClN3S/c24-20-13-11-18(12-14-20)21-15-22(19-9-5-2-6-10-19)27(26-21)23(28)25-16-17-7-3-1-4-8-17/h1-14,22H,15-16H2,(H,25,28)