5-tert-butyl-N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[4-[1,4-diazepan-1-yl(oxo)methyl]-2-methylphenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-N-[4-(1,4-diazepane-1-carbonyl)-2-methylphenyl]-2-methylpyrazole-3-carboxamide Traditional Name: 5-tert-butyl-N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]-2-methyl-pyrazole-3-carboxamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=CC(=NN3C)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=CC(=NN3C)C(C)(C)C

InChI

InChI=1S/C22H31N5O2/c1-15-13-16(21(29)27-11-6-9-23-10-12-27)7-8-17(15)24-20(28)18-14-19(22(2,3)4)25-26(18)5/h7-8,13-14,23H,6,9-12H2,1-5H3,(H,24,28)