[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C=CC2=CC=CS2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)/C=C/C2=CC=CS2)Br

InChI

InChI=1S/C16H14BrNO3S/c1-11-9-12(4-6-14(11)17)18-15(19)10-21-16(20)7-5-13-3-2-8-22-13/h2-9H,10H2,1H3,(H,18,19)/b7-5+