methyl 5-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-bromo-3-methoxy-2-naphthoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C20H15BrN2O4S MolecularWeight: 459.3131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)C(=O)OC

InChI

InChI=1S/C20H15BrN2O4S/c1-10-14(9-22)19(28-17(10)20(25)27-3)23-18(24)13-8-11-6-4-5-7-12(11)15(21)16(13)26-2/h4-8H,1-3H3,(H,23,24)