methyl 2-[[3-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]phenyl]carbonyloxymethyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[3-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]phenyl]carbonyloxymethyl]furan-3-carboxylate Openeye Name: methyl 2-[[3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoyl]oxymethyl]furan-3-carboxylate CAS Name: 2-[[[3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]phenyl]-oxomethoxy]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoyl]oxymethyl]furan-3-carboxylate Traditional Name: 2-[[3-[2-amino-3-(1,3-benzothiazol-2-yl)-4-keto-2-pyrrolin-1-yl]benzoyl]oxymethyl]furan-3-carboxylic acid methyl ester Formula: C25H19N3O6S MolecularWeight: 489.49986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)COC(=O)C2=CC(=CC=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC(=O)C1=C(OC=C1)COC(=O)C2=CC(=CC=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H19N3O6S/c1-32-25(31)16-9-10-33-19(16)13-34-24(30)14-5-4-6-15(11-14)28-12-18(29)21(22(28)26)23-27-17-7-2-3-8-20(17)35-23/h2-11H,12-13,26H2,1H3