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

Systemtic Name: 5-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxidanylidene-propan-2-yl]phenyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-N-[4-[2-(1,4-diazepan-1-yl)-1-methyl-2-oxo-ethyl]phenyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]-2-methylpyrazole-3-carboxamide Traditional Name: 5-tert-butyl-N-[4-[2-(1,4-diazepan-1-yl)-2-keto-1-methyl-ethyl]phenyl]-2-methyl-pyrazole-3-carboxamide Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C)C(C)(C)C)C(=O)N3CCCNCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C)C(C)(C)C)C(=O)N3CCCNCC3

InChI

InChI=1S/C23H33N5O2/c1-16(22(30)28-13-6-11-24-12-14-28)17-7-9-18(10-8-17)25-21(29)19-15-20(23(2,3)4)26-27(19)5/h7-10,15-16,24H,6,11-14H2,1-5H3,(H,25,29)