2-[3-(4-methylphenyl)sulfanylpropanoylamino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide

Systemtic Name: 2-[3-(4-methylphenyl)sulfanylpropanoylamino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide Openeye Name: 6-isopropyl-2-[3-(p-tolylsulfanyl)propanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide CAS Name: 2-[[3-[(4-methylphenyl)thio]-1-oxopropyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide IUPAC Name: 2-[3-(4-methylphenyl)sulfanylpropanoylamino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide Traditional Name: 6-isopropyl-2-[3-(p-tolylthio)propanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2S2/c1-13(2)24-10-8-16-17(12-24)28-21(19(16)20(22)26)23-18(25)9-11-27-15-6-4-14(3)5-7-15/h4-7,13H,8-12H2,1-3H3,(H2,22,26)(H,23,25)