ethyl 3-aminocarbonyl-2-[4-(4-methoxyphenyl)sulfanylbutanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-aminocarbonyl-2-[4-(4-methoxyphenyl)sulfanylbutanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-carbamoyl-2-[4-(4-methoxyphenyl)sulfanylbutanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-carbamoyl-2-[[4-[(4-methoxyphenyl)thio]-1-oxobutyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-carbamoyl-2-[4-(4-methoxyphenyl)sulfanylbutanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-carbamoyl-2-[4-[(4-methoxyphenyl)thio]butanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C22H27N3O5S2 MolecularWeight: 477.59688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O5S2/c1-3-30-22(28)25-11-10-16-17(13-25)32-21(19(16)20(23)27)24-18(26)5-4-12-31-15-8-6-14(29-2)7-9-15/h6-9H,3-5,10-13H2,1-2H3,(H2,23,27)(H,24,26)