N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(methylthio)nicotinamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H20N4OS2/c1-28-21-14(8-6-12-23-21)20(27)26-22-18(13-7-2-5-11-17(13)29-22)19-24-15-9-3-4-10-16(15)25-19/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,24,25)(H,26,27)