O2-[(2-acetamido-1,3-thiazol-4-yl)methyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[(2-acetamido-1,3-thiazol-4-yl)methyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[(2-acetamidothiazol-4-yl)methyl] O4-isopropyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[(2-acetamido-4-thiazolyl)methyl] ester O4-propan-2-yl ester IUPAC Name: 2-O-[(2-acetamido-1,3-thiazol-4-yl)methyl] 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-[(2-acetamidothiazol-4-yl)methyl] ester O4-isopropyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC2=CSC(=N2)NC(=O)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC2=CSC(=N2)NC(=O)C

InChI

InChI=1S/C17H21N3O5S/c1-8(2)25-15(22)13-9(3)14(18-10(13)4)16(23)24-6-12-7-26-17(20-12)19-11(5)21/h7-8,18H,6H2,1-5H3,(H,19,20,21)