ethyl 3-(1,3-benzothiazol-2-yl)-2-[2-[2,4-bis(chloranyl)phenoxy]ethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[2-[2,4-bis(chloranyl)phenoxy]ethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-[[2-(2,4-dichlorophenoxy)-1-oxoethyl]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-(2,4-dichlorophenoxy)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C25H21Cl2N3O4S2 MolecularWeight: 562.48794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)COC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)COC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C25H21Cl2N3O4S2/c1-2-33-25(32)30-10-9-15-20(12-30)36-24(22(15)23-28-17-5-3-4-6-19(17)35-23)29-21(31)13-34-18-8-7-14(26)11-16(18)27/h3-8,11H,2,9-10,12-13H2,1H3,(H,29,31)