N-methyl-5-(4-methylphenyl)-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: N-methyl-5-(4-methylphenyl)-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-methyl-5-(p-tolyl)-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-methyl-5-(4-methylphenyl)-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-methyl-5-(4-methylphenyl)-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-methyl-3-(p-tolyl)-5-(1H-pyrrol-2-yl)-2-pyrazoline-1-carbothioamide Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CN3)C(=S)NC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CN3)C(=S)NC

InChI

InChI=1S/C16H18N4S/c1-11-5-7-12(8-6-11)14-10-15(13-4-3-9-18-13)20(19-14)16(21)17-2/h3-9,15,18H,10H2,1-2H3,(H,17,21)