N-[4-[2-(2,5-dimethylphenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]phenyl]-3-methoxy-benzamide

Systemtic Name: N-[4-[2-(2,5-dimethylphenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]phenyl]-3-methoxy-benzamide Openeye Name: N-[4-[2-(2,5-dimethylphenyl)-5-isopropyl-3-oxo-1H-pyrazol-4-yl]phenyl]-3-methoxy-benzamide CAS Name: N-[4-[2-(2,5-dimethylphenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]phenyl]-3-methoxybenzamide IUPAC Name: N-[4-[2-(2,5-dimethylphenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]phenyl]-3-methoxybenzamide Traditional Name: N-[4-[1-(2,5-dimethylphenyl)-3-isopropyl-5-keto-3-pyrazolin-4-yl]phenyl]-3-methoxy-benzamide Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C(=C(N2)C(C)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C(=C(N2)C(C)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C28H29N3O3/c1-17(2)26-25(28(33)31(30-26)24-15-18(3)9-10-19(24)4)20-11-13-22(14-12-20)29-27(32)21-7-6-8-23(16-21)34-5/h6-17,30H,1-5H3,(H,29,32)