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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2CC(=O)N3CCCNCC3)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2CC(=O)N3CCCNCC3)C

InChI

InChI=1S/C22H31N5O2/c1-22(2,3)19-15-18(26(4)25-19)21(29)24-17-9-6-5-8-16(17)14-20(28)27-12-7-10-23-11-13-27/h5-6,8-9,15,23H,7,10-14H2,1-4H3,(H,24,29)