methyl 3-aminocarbonyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: methyl 3-aminocarbonyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 3-carbamoyl-2-[[2-(p-tolylsulfanyl)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-carbamoyl-2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-carbamoyl-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-carbamoyl-2-[[2-(p-tolylthio)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C19H21N3O4S2 MolecularWeight: 419.51774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)OC)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)OC)C(=O)N

InChI

InChI=1S/C19H21N3O4S2/c1-11-3-5-12(6-4-11)27-10-15(23)21-18-16(17(20)24)13-7-8-22(19(25)26-2)9-14(13)28-18/h3-6H,7-10H2,1-2H3,(H2,20,24)(H,21,23)