[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate

Systemtic Name: [2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate Openeye Name: [2-[methyl(3-thienylmethyl)amino]-2-oxo-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate CAS Name: (E)-3-(4-bromophenyl)-2-propenoic acid [2-[methyl(3-thiophenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl] (E)-3-(4-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(4-bromophenyl)acrylic acid [2-keto-2-[methyl(3-thenyl)amino]ethyl] ester Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)COC(=O)C=CC2=CC=C(C=C2)Br

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)COC(=O)/C=C/C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO3S/c1-19(10-14-8-9-23-12-14)16(20)11-22-17(21)7-4-13-2-5-15(18)6-3-13/h2-9,12H,10-11H2,1H3/b7-4+