ethyl 3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoylamino]benzoate

Systemtic Name: ethyl 3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoylamino]benzoate Openeye Name: ethyl 3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoylamino]benzoate CAS Name: 3-[[oxo-[(1,3,5-trimethyl-4-pyrazolyl)methylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoylamino]benzoate Traditional Name: 3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoylamino]benzoic acid ethyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=C(N(N=C2C)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=C(N(N=C2C)C)C

InChI

InChI=1S/C17H22N4O3/c1-5-24-16(22)13-7-6-8-14(9-13)19-17(23)18-10-15-11(2)20-21(4)12(15)3/h6-9H,5,10H2,1-4H3,(H2,18,19,23)