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

Systemtic Name: 3-[5-azanyl-4-(3-piperazin-1-ylcarbonylphenyl)carbonyl-pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[5-amino-4-[3-(piperazine-1-carbonyl)benzoyl]pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[5-amino-4-[oxo-[3-[oxo(1-piperazinyl)methyl]phenyl]methyl]-1-pyrazolyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[5-amino-4-[3-(piperazine-1-carbonyl)benzoyl]pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[5-amino-4-[3-(piperazine-1-carbonyl)benzoyl]pyrazol-1-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C26H28N6O3 MolecularWeight: 472.53892

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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)N5CCNCC5)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C(=C(C=N3)C(=O)C4=CC(=CC=C4)C(=O)N5CCNCC5)N

InChI

InChI=1S/C26H28N6O3/c1-16-5-6-18(25(34)30-20-7-8-20)14-22(16)32-24(27)21(15-29-32)23(33)17-3-2-4-19(13-17)26(35)31-11-9-28-10-12-31/h2-6,13-15,20,28H,7-12,27H2,1H3,(H,30,34)