[2-[[1-(4-cyanobutyl)pyrazol-4-yl]amino]-2-oxidanylidene-1-phenyl-ethyl] ethanoate

Systemtic Name: [2-[[1-(4-cyanobutyl)pyrazol-4-yl]amino]-2-oxidanylidene-1-phenyl-ethyl] ethanoate Openeye Name: [2-[[1-(4-cyanobutyl)pyrazol-4-yl]amino]-2-oxo-1-phenyl-ethyl] acetate CAS Name: acetic acid [2-[[1-(4-cyanobutyl)-4-pyrazolyl]amino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[[1-(4-cyanobutyl)pyrazol-4-yl]amino]-2-oxo-1-phenylethyl] acetate Traditional Name: acetic acid [2-[[1-(4-cyanobutyl)pyrazol-4-yl]amino]-2-keto-1-phenyl-ethyl] ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(=O)NC2=CN(N=C2)CCCCC#N

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1)C(=O)NC2=CN(N=C2)CCCCC#N

InChI

InChI=1S/C18H20N4O3/c1-14(23)25-17(15-8-4-2-5-9-15)18(24)21-16-12-20-22(13-16)11-7-3-6-10-19/h2,4-5,8-9,12-13,17H,3,6-7,11H2,1H3,(H,21,24)