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

Systemtic Name: N-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-phenyl-N-(p-tolyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-(4-methylphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-phenyl-N-(p-tolyl)-2-pyrazoline-1-carbothioamide Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2C(CC=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2C(CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3S/c1-13-7-9-15(10-8-13)19-17(21)20-16(11-12-18-20)14-5-3-2-4-6-14/h2-10,12,16H,11H2,1H3,(H,19,21)