2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid Openeye Name: 2-[[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid CAS Name: 2-[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid IUPAC Name: 2-[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]-4,5-dimethylthiophene-3-carboxylic acid Traditional Name: 2-[[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]-4,5-dimethyl-3-thenoic acid Formula: C14H12BrNO3S2 MolecularWeight: 386.28398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)C=CC2=CC=C(S2)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)/C=C/C2=CC=C(S2)Br)C

InChI

InChI=1S/C14H12BrNO3S2/c1-7-8(2)20-13(12(7)14(18)19)16-11(17)6-4-9-3-5-10(15)21-9/h3-6H,1-2H3,(H,16,17)(H,18,19)/b6-4+