4-(3,5-diphenylpyrazol-1-yl)-N-(4-ethoxyphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(3,5-diphenylpyrazol-1-yl)-N-(4-ethoxyphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(3,5-diphenylpyrazol-1-yl)-N-(4-ethoxyphenyl)-4-oxo-butanamide CAS Name: 4-(3,5-diphenyl-1-pyrazolyl)-N-(4-ethoxyphenyl)-4-oxobutanamide IUPAC Name: 4-(3,5-diphenylpyrazol-1-yl)-N-(4-ethoxyphenyl)-4-oxobutanamide Traditional Name: 4-(3,5-diphenylpyrazol-1-yl)-4-keto-N-p-phenetyl-butyramide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)N2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3/c1-2-33-23-15-13-22(14-16-23)28-26(31)17-18-27(32)30-25(21-11-7-4-8-12-21)19-24(29-30)20-9-5-3-6-10-20/h3-16,19H,2,17-18H2,1H3,(H,28,31)