N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-[2-(3-methylphenyl)ethanoylamino]pyrazol-1-yl]benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-[2-(3-methylphenyl)ethanoylamino]pyrazol-1-yl]benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[4-[[2-(m-tolyl)acetyl]amino]pyrazol-1-yl]benzamide CAS Name: N-(2-amino-2-oxoethyl)-3-[4-[[2-(3-methylphenyl)-1-oxoethyl]amino]-1-pyrazolyl]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[4-[[2-(3-methylphenyl)acetyl]amino]pyrazol-1-yl]benzamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[4-[[2-(m-tolyl)acetyl]amino]pyrazol-1-yl]benzamide Formula: C21H21N5O3 MolecularWeight: 391.42314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)NC2=CN(N=C2)C3=CC=CC(=C3)C(=O)NCC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)NC2=CN(N=C2)C3=CC=CC(=C3)C(=O)NCC(=O)N

InChI

InChI=1S/C21H21N5O3/c1-14-4-2-5-15(8-14)9-20(28)25-17-11-24-26(13-17)18-7-3-6-16(10-18)21(29)23-12-19(22)27/h2-8,10-11,13H,9,12H2,1H3,(H2,22,27)(H,23,29)(H,25,28)