N-ethyl-5-phenyl-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1C(CC(=N1)C2=CC=CC=C2)C3=CC=CN3

Isomeric SMILES

CCNC(=S)N1C(CC(=N1)C2=CC=CC=C2)C3=CC=CN3

InChI

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