O2-(1,3-benzothiazol-2-ylmethyl) O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-(1,3-benzothiazol-2-ylmethyl) O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-(1,3-benzothiazol-2-ylmethyl) O4-isopropyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1,3-benzothiazol-2-ylmethyl) ester O4-propan-2-yl ester IUPAC Name: 2-O-(1,3-benzothiazol-2-ylmethyl) 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1,3-benzothiazol-2-ylmethyl) ester O4-isopropyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N2O4S/c1-10(2)25-18(22)16-11(3)17(20-12(16)4)19(23)24-9-15-21-13-7-5-6-8-14(13)26-15/h5-8,10,20H,9H2,1-4H3