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

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[(3,4-dimethoxyphenyl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[(3,4-dimethoxybenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-[[(3,4-dimethoxyphenyl)-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-[(3,4-dimethoxybenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-(veratroylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C26H25N3O5S2 MolecularWeight: 523.6238

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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(=C(C=C5)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H25N3O5S2/c1-4-34-26(31)29-12-11-16-21(14-29)36-25(22(16)24-27-17-7-5-6-8-20(17)35-24)28-23(30)15-9-10-18(32-2)19(13-15)33-3/h5-10,13H,4,11-12,14H2,1-3H3,(H,28,30)