2-[[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-phenyl-ethanamide

Systemtic Name: 2-[[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)tetrazol-5-yl]sulfanyl-2-phenyl-acetamide CAS Name: 2-[[1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-tetrazolyl]thio]-2-phenylacetamide IUPAC Name: 2-[1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)tetrazol-5-yl]sulfanyl-2-phenylacetamide Traditional Name: 2-[[1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)tetrazol-5-yl]thio]-2-phenyl-acetamide Formula: C20H19N7O2S MolecularWeight: 421.47556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=NN=N3)SC(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=NN=N3)SC(C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C20H19N7O2S/c1-13-16(19(29)27(25(13)2)15-11-7-4-8-12-15)26-20(22-23-24-26)30-17(18(21)28)14-9-5-3-6-10-14/h3-12,17H,1-2H3,(H2,21,28)