[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H14BrNO4S/c1-10-3-2-4-11(7-10)16(21)18-8-15(20)22-9-12(19)13-5-6-14(17)23-13/h2-7H,8-9H2,1H3,(H,18,21)