ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methoxy]ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methoxy]ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[(2-phenylthiazol-4-yl)methoxy]ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-oxo-2-[(2-phenyl-4-thiazolyl)methoxy]ethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-oxo-2-[(2-phenyl-1,3-thiazol-4-yl)methoxy]ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-[(2-phenylthiazol-4-yl)methoxy]ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O4S/c1-4-26-21(25)18-10-14(2)23(15(18)3)11-19(24)27-12-17-13-28-20(22-17)16-8-6-5-7-9-16/h5-10,13H,4,11-12H2,1-3H3