[4-[N-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate

Systemtic Name: [4-[N-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate Openeye Name: [4-[N-[(5-tert-butyl-1H-pyrazole-3-carbonyl)amino]-C-methyl-carbonimidoyl]phenyl] acetate CAS Name: acetic acid [4-[1-[[(5-tert-butyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [4-[N-[(5-tert-butyl-1H-pyrazole-3-carbonyl)amino]-C-methylcarbonimidoyl]phenyl] acetate Traditional Name: acetic acid [4-[N-[(5-tert-butyl-1H-pyrazole-3-carbonyl)amino]-C-methyl-carbonimidoyl]phenyl] ester Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NNC(=C1)C(C)(C)C)C2=CC=C(C=C2)OC(=O)C

Isomeric SMILES

CC(=NNC(=O)C1=NNC(=C1)C(C)(C)C)C2=CC=C(C=C2)OC(=O)C

InChI

InChI=1S/C18H22N4O3/c1-11(13-6-8-14(9-7-13)25-12(2)23)19-22-17(24)15-10-16(21-20-15)18(3,4)5/h6-10H,1-5H3,(H,20,21)(H,22,24)