potassium 3-(4-bromophenyl)carbonyl-4-ethoxycarbonyl-6-methyl-thieno[3,4-b]indolizine-1-thiolate

Systemtic Name: potassium 3-(4-bromophenyl)carbonyl-4-ethoxycarbonyl-6-methyl-thieno[3,4-b]indolizine-1-thiolate Openeye Name: potassium 3-(4-bromobenzoyl)-4-ethoxycarbonyl-6-methyl-thieno[3,4-b]indolizine-1-thiolate CAS Name: potassium 3-[(4-bromophenyl)-oxomethyl]-4-ethoxycarbonyl-6-methyl-1-thieno[3,4-b]indolizinethiolate IUPAC Name: potassium 3-(4-bromobenzoyl)-4-ethoxycarbonyl-6-methylthieno[3,4-b]indolizine-1-thiolate Traditional Name: potassium 3-(4-bromobenzoyl)-4-carbethoxy-6-methyl-thien[3,4-b]indolizine-1-thiolate Formula: C21H15BrKNO3S2 MolecularWeight: 512.481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=C(C=C4)Br)[S-])C.[K+]

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=C(C=C4)Br)[S-])C.[K+]

InChI

InChI=1S/C21H16BrNO3S2.K/c1-3-26-20(25)15-14-10-11(2)8-9-23(14)17-16(15)19(28-21(17)27)18(24)12-4-6-13(22)7-5-12;/h4-10,27H,3H2,1-2H3;/q;+1/p-1