ethyl 1-azanyl-2-(4-chlorophenyl)carbonyl-5,7-dimethyl-thieno[2,3-b]indolizine-4-carboxylate

Systemtic Name: ethyl 1-azanyl-2-(4-chlorophenyl)carbonyl-5,7-dimethyl-thieno[2,3-b]indolizine-4-carboxylate Openeye Name: ethyl 1-amino-2-(4-chlorobenzoyl)-5,7-dimethyl-thieno[2,3-b]indolizine-4-carboxylate CAS Name: 1-amino-2-[(4-chlorophenyl)-oxomethyl]-5,7-dimethyl-4-thieno[2,3-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-amino-2-(4-chlorobenzoyl)-5,7-dimethylthieno[2,3-b]indolizine-4-carboxylate Traditional Name: 1-amino-2-(4-chlorobenzoyl)-5,7-dimethyl-thien[2,3-b]indolizine-4-carboxylic acid ethyl ester Formula: C22H19ClN2O3S MolecularWeight: 426.91586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC(=CN2C3=C1SC(=C3N)C(=O)C4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC(=CN2C3=C1SC(=C3N)C(=O)C4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C22H19ClN2O3S/c1-4-28-22(27)15-17-12(3)9-11(2)10-25(17)18-16(24)21(29-20(15)18)19(26)13-5-7-14(23)8-6-13/h5-10H,4,24H2,1-3H3