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

Systemtic Name: 3-[4-(3-aminocarbonylphenyl)carbonyl-5-azanyl-pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[5-amino-4-(3-carbamoylbenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[5-amino-4-[(3-carbamoylphenyl)-oxomethyl]-1-pyrazolyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[5-amino-4-(3-carbamoylbenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[5-amino-4-(3-carbamoylbenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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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)C4=CC(=CC=C4)C(=O)N)N

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O3/c1-12-5-6-15(22(30)26-16-7-8-16)10-18(12)27-20(23)17(11-25-27)19(28)13-3-2-4-14(9-13)21(24)29/h2-6,9-11,16H,7-8,23H2,1H3,(H2,24,29)(H,26,30)