ethyl 1-(3-bromophenyl)-4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethoxy]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethoxy]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethoxy]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-6-keto-4-[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethoxy]pyridazine-3-carboxylic acid ethyl ester Formula: C23H19BrN4O5S MolecularWeight: 543.38976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H19BrN4O5S/c1-3-32-22(31)21-17(11-20(30)28(27-21)15-6-4-5-14(24)10-15)33-12-19(29)26-23-25-16-8-7-13(2)9-18(16)34-23/h4-11H,3,12H2,1-2H3,(H,25,26,29)