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

Systemtic Name: 3-[5-azanyl-4-(4-methylphenyl)carbonyl-pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[5-amino-4-(4-methylbenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[5-amino-4-[(4-methylphenyl)-oxomethyl]-1-pyrazolyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[5-amino-4-(4-methylbenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-(5-amino-4-p-toluoyl-pyrazol-1-yl)-N-cyclopropyl-4-methyl-benzamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(N(N=C2)C3=C(C=CC(=C3)C(=O)NC4CC4)C)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(N(N=C2)C3=C(C=CC(=C3)C(=O)NC4CC4)C)N

InChI

InChI=1S/C22H22N4O2/c1-13-3-6-15(7-4-13)20(27)18-12-24-26(21(18)23)19-11-16(8-5-14(19)2)22(28)25-17-9-10-17/h3-8,11-12,17H,9-10,23H2,1-2H3,(H,25,28)