methyl 2-[(2-ethylsulfanylphenyl)carbonylamino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-[(2-ethylsulfanylphenyl)carbonylamino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-[(2-ethylsulfanylbenzoyl)amino]-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[[2-(ethylthio)phenyl]-oxomethyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-ethylsulfanylbenzoyl)amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-[[2-(ethylthio)benzoyl]amino]-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CN(CC3)C(C)C)C(=O)OC

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CN(CC3)C(C)C)C(=O)OC

InChI

InChI=1S/C21H26N2O3S2/c1-5-27-16-9-7-6-8-15(16)19(24)22-20-18(21(25)26-4)14-10-11-23(13(2)3)12-17(14)28-20/h6-9,13H,5,10-12H2,1-4H3,(H,22,24)