[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-thiophen-2-ylpropanoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C16H16BrNO3S MolecularWeight: 382.27214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCC2=CC=CS2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCC2=CC=CS2)Br

InChI

InChI=1S/C16H16BrNO3S/c1-11-4-6-14(13(17)9-11)18-15(19)10-21-16(20)7-5-12-3-2-8-22-12/h2-4,6,8-9H,5,7,10H2,1H3,(H,18,19)