[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] (E)-3-(5-bromo-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-propenoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] (E)-3-(5-bromothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-thienyl)acrylic acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)C=CC2=CC=C(S2)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)/C=C/C2=CC=C(S2)Br

InChI

InChI=1S/C16H14BrNO3S/c1-11-3-2-4-12(9-11)18-15(19)10-21-16(20)8-6-13-5-7-14(17)22-13/h2-9H,10H2,1H3,(H,18,19)/b8-6+