3-[5-azanyl-4-(2-phenylethanoyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[5-azanyl-4-(2-phenylethanoyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[5-amino-4-(2-phenylacetyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[5-amino-4-(1-oxo-2-phenylethyl)-1-pyrazolyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[5-amino-4-(2-phenylacetyl)pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[5-amino-4-(2-phenylacetyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C(=C(C=N3)C(=O)CC4=CC=CC=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C(=C(C=N3)C(=O)CC4=CC=CC=C4)N

InChI

InChI=1S/C22H22N4O2/c1-14-7-8-16(22(28)25-17-9-10-17)12-19(14)26-21(23)18(13-24-26)20(27)11-15-5-3-2-4-6-15/h2-8,12-13,17H,9-11,23H2,1H3,(H,25,28)