N-[2-(4-methylsulfanylphenyl)ethyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-[2-(4-methylsulfanylphenyl)ethyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-[2-(4-methylsulfanylphenyl)ethyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-[2-[4-(methylthio)phenyl]ethyl]-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-[2-(4-methylsulfanylphenyl)ethyl]-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-[2-[4-(methylthio)phenyl]ethyl]-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)C2=C(C3=C(S2)N=CC=C3)N4C=CC=C4

InChI

InChI=1S/C21H19N3OS2/c1-26-16-8-6-15(7-9-16)10-12-22-20(25)19-18(24-13-2-3-14-24)17-5-4-11-23-21(17)27-19/h2-9,11,13-14H,10,12H2,1H3,(H,22,25)