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

Systemtic Name: 5-phenyl-N-propyl-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-phenyl-N-propyl-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-phenyl-N-propyl-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-phenyl-N-propyl-3-(1H-pyrrol-2-yl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-phenyl-N-propyl-5-(1H-pyrrol-2-yl)-2-pyrazoline-1-carbothioamide Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4S/c1-2-10-19-17(22)21-16(14-9-6-11-18-14)12-15(20-21)13-7-4-3-5-8-13/h3-9,11,16,18H,2,10,12H2,1H3,(H,19,22)