ethyl 3-(1,3-benzothiazol-2-yl)-2-[(2-bromophenyl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[(2-bromophenyl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[(2-bromobenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-[[(2-bromophenyl)-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[(2-bromobenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-[(2-bromobenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C24H20BrN3O3S2 MolecularWeight: 542.4679

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CC=C5Br

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C24H20BrN3O3S2/c1-2-31-24(30)28-12-11-15-19(13-28)33-23(27-21(29)14-7-3-4-8-16(14)25)20(15)22-26-17-9-5-6-10-18(17)32-22/h3-10H,2,11-13H2,1H3,(H,27,29)