5-tert-butyl-2-methyl-N-[3-(4-methylpiperazin-1-yl)carbonylphenyl]pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[3-(4-methylpiperazin-1-yl)carbonylphenyl]pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-2-methyl-N-[3-(4-methylpiperazine-1-carbonyl)phenyl]pyrazole-3-carboxamide CAS Name: 5-tert-butyl-2-methyl-N-[3-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-2-methyl-N-[3-(4-methylpiperazine-1-carbonyl)phenyl]pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-2-methyl-N-[3-(4-methylpiperazine-1-carbonyl)phenyl]pyrazole-3-carboxamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C)C

InChI

InChI=1S/C21H29N5O2/c1-21(2,3)18-14-17(25(5)23-18)19(27)22-16-8-6-7-15(13-16)20(28)26-11-9-24(4)10-12-26/h6-8,13-14H,9-12H2,1-5H3,(H,22,27)