3-[(4-bromanyl-3-methyl-phenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-bromo-3-methyl-benzoyl)-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(4-bromo-3-methylphenyl)-oxomethyl]-methylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-bromo-3-methylbenzoyl)-methylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-bromo-3-methyl-benzoyl)-methyl-amino]-5-phenyl-2-thenoic acid Formula: C20H16BrNO3S MolecularWeight: 430.31494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)Br

InChI

InChI=1S/C20H16BrNO3S/c1-12-10-14(8-9-15(12)21)19(23)22(2)16-11-17(26-18(16)20(24)25)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,24,25)