N-[1-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide

Systemtic Name: N-[1-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide Openeye Name: N-[1-[2-(o-tolylmethylamino)-2-oxo-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide CAS Name: N-[1-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]-4-pyrazolyl]-3-phenoxypropanamide IUPAC Name: N-[1-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]pyrazol-4-yl]-3-phenoxypropanamide Traditional Name: N-[1-[2-keto-2-[(2-methylbenzyl)amino]ethyl]pyrazol-4-yl]-3-phenoxy-propionamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3/c1-17-7-5-6-8-18(17)13-23-22(28)16-26-15-19(14-24-26)25-21(27)11-12-29-20-9-3-2-4-10-20/h2-10,14-15H,11-13,16H2,1H3,(H,23,28)(H,25,27)