3,5-bis(azanyl)-N-phenyl-1-(2-phenylethanoyl)pyrazole-4-carbothioamide

Systemtic Name: 3,5-bis(azanyl)-N-phenyl-1-(2-phenylethanoyl)pyrazole-4-carbothioamide Openeye Name: 3,5-diamino-N-phenyl-1-(2-phenylacetyl)pyrazole-4-carbothioamide CAS Name: 3,5-diamino-1-(1-oxo-2-phenylethyl)-N-phenyl-4-pyrazolecarbothioamide IUPAC Name: 3,5-diamino-N-phenyl-1-(2-phenylacetyl)pyrazole-4-carbothioamide Traditional Name: 3,5-diamino-N-phenyl-1-(2-phenylacetyl)pyrazole-4-carbothioamide Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)N2C(=C(C(=N2)N)C(=S)NC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N2C(=C(C(=N2)N)C(=S)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H17N5OS/c19-16-15(18(25)21-13-9-5-2-6-10-13)17(20)23(22-16)14(24)11-12-7-3-1-4-8-12/h1-10H,11,20H2,(H2,19,22)(H,21,25)