methyl 4-[[2-(thiophen-2-ylmethyl)pyrazol-3-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(thiophen-2-ylmethyl)pyrazol-3-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(2-thienylmethyl)pyrazol-3-yl]carbamoyl]benzoate CAS Name: 4-[oxo-[[2-(thiophen-2-ylmethyl)-3-pyrazolyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(thiophen-2-ylmethyl)pyrazol-3-yl]carbamoyl]benzoate Traditional Name: 4-[[2-(2-thenyl)pyrazol-3-yl]carbamoyl]benzoic acid methyl ester Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=CC=CS3

InChI

InChI=1S/C17H15N3O3S/c1-23-17(22)13-6-4-12(5-7-13)16(21)19-15-8-9-18-20(15)11-14-3-2-10-24-14/h2-10H,11H2,1H3,(H,19,21)