[1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 3-fluoranylbenzoate

Systemtic Name: [1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 3-fluoranylbenzoate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C15H13FN2O4S MolecularWeight: 336.338123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)OC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)OC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C15H13FN2O4S/c1-8(22-15(21)9-3-2-4-10(16)7-9)13(20)18-14-11(12(17)19)5-6-23-14/h2-8H,1H3,(H2,17,19)(H,18,20)