ethyl 4-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(3-bromophenyl)thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-(3-bromophenyl)-4-thiazolyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(3-bromophenyl)thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CSC(=N2)C3=CC(=CC=C3)Br)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CSC(=N2)C3=CC(=CC=C3)Br)C)C

InChI

InChI=1S/C18H17BrN2O2S/c1-4-23-18(22)16-11(3)20-10(2)15(16)14-9-24-17(21-14)12-6-5-7-13(19)8-12/h5-9,20H,4H2,1-3H3