N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H20N6O2S MolecularWeight: 372.4447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCSC3=NNC(=N3)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCSC3=NNC(=N3)C

InChI

InChI=1S/C17H20N6O2S/c1-11-15(16(25)23(22(11)3)13-7-5-4-6-8-13)19-14(24)9-10-26-17-18-12(2)20-21-17/h4-8H,9-10H2,1-3H3,(H,19,24)(H,18,20,21)