[2-bromanyl-6-methoxy-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate

Systemtic Name: [2-bromanyl-6-methoxy-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate Openeye Name: [2-bromo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-bromo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-bromo-4-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-6-methoxy-phenyl] ester Formula: C23H17BrN2O4S MolecularWeight: 497.36108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C(=C2)Br)OC(=O)C3=CC=CS3)OC)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C(=C2)Br)OC(=O)C3=CC=CS3)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H17BrN2O4S/c1-14-17(22(27)26(25-14)16-7-4-3-5-8-16)11-15-12-18(24)21(19(13-15)29-2)30-23(28)20-9-6-10-31-20/h3-13H,1-2H3/b17-11+