methyl 4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-4-oxidanyl-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-4-oxidanyl-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[4-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[4-hydroxy-5-keto-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-(2-thenoyl)-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C25H18N2O6S2 MolecularWeight: 506.55022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C25H18N2O6S2/c1-32-15-9-10-16-18(12-15)35-25(26-16)27-20(13-5-7-14(8-6-13)24(31)33-2)19(22(29)23(27)30)21(28)17-4-3-11-34-17/h3-12,20,29H,1-2H3