ethyl 2-(4-bromophenyl)carbonyl-1-methyl-thieno[2,3-b]indolizine-4-carboxylate

Systemtic Name: ethyl 2-(4-bromophenyl)carbonyl-1-methyl-thieno[2,3-b]indolizine-4-carboxylate Openeye Name: ethyl 2-(4-bromobenzoyl)-1-methyl-thieno[2,3-b]indolizine-4-carboxylate CAS Name: 2-[(4-bromophenyl)-oxomethyl]-1-methyl-4-thieno[2,3-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-bromobenzoyl)-1-methylthieno[2,3-b]indolizine-4-carboxylate Traditional Name: 2-(4-bromobenzoyl)-1-methyl-thien[2,3-b]indolizine-4-carboxylic acid ethyl ester Formula: C21H16BrNO3S MolecularWeight: 442.32564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C3=C1SC(=C3C)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C3=C1SC(=C3C)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrNO3S/c1-3-26-21(25)16-15-6-4-5-11-23(15)17-12(2)19(27-20(16)17)18(24)13-7-9-14(22)10-8-13/h4-11H,3H2,1-2H3