5-phenyl-N-(phenylmethyl)-3,4-dihydropyrazole-2-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3S/c21-17(18-13-14-7-3-1-4-8-14)20-12-11-16(19-20)15-9-5-2-6-10-15/h1-10H,11-13H2,(H,18,21)