O6-ethyl O3-methyl 4-methyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrolo[3,2-c][1,2]thiazole-3,6-dicarboxylate

Systemtic Name: O6-ethyl O3-methyl 4-methyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrolo[3,2-c][1,2]thiazole-3,6-dicarboxylate Openeye Name: O6-ethyl O3-methyl 1-benzyl-4-methyl-2,5-dioxo-pyrrolo[3,2-c]isothiazole-3,6-dicarboxylate CAS Name: 4-methyl-2,5-dioxo-1-(phenylmethyl)pyrrolo[3,2-c]isothiazole-3,6-dicarboxylic acid O6-ethyl ester O3-methyl ester IUPAC Name: 6-O-ethyl 3-O-methyl 1-benzyl-4-methyl-2,5-dioxopyrrolo[3,2-c][1,2]thiazole-3,6-dicarboxylate Traditional Name: 1-benzyl-2,5-diketo-4-methyl-pyrrol[3,2-c]isothiazole-3,6-dicarboxylic acid O6-ethyl ester O3-methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C(S(=O)N2CC3=CC=CC=C3)C(=O)OC)N(C1=O)C

Isomeric SMILES

CCOC(=O)C1=C2C(=C(S(=O)N2CC3=CC=CC=C3)C(=O)OC)N(C1=O)C

InChI

InChI=1S/C18H18N2O6S/c1-4-26-17(22)12-13-14(19(2)16(12)21)15(18(23)25-3)27(24)20(13)10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3