3-phenacyl-5-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-phenacyl-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-phenacyl-5-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-phenacyl-5-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-phenacyl-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-phenacyl-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=S)N)CC(=O)C3=CC=CC=C3

Isomeric SMILES

C1C(N(N=C1C2=CC=CC=C2)C(=S)N)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS/c19-18(23)21-15(12-17(22)14-9-5-2-6-10-14)11-16(20-21)13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H2,19,23)