5-azanyl-3-(1H-benzimidazol-2-yl)-2-phenacylsulfanyl-7-phenyl-thieno[3,2-b]pyridine-6-carbonitrile

Systemtic Name: 5-azanyl-3-(1H-benzimidazol-2-yl)-2-phenacylsulfanyl-7-phenyl-thieno[3,2-b]pyridine-6-carbonitrile Openeye Name: 5-amino-3-(1H-benzimidazol-2-yl)-2-phenacylsulfanyl-7-phenyl-thieno[3,2-b]pyridine-6-carbonitrile CAS Name: 5-amino-3-(1H-benzimidazol-2-yl)-2-(phenacylthio)-7-phenyl-6-thieno[3,2-b]pyridinecarbonitrile IUPAC Name: 5-amino-3-(1H-benzimidazol-2-yl)-2-phenacylsulfanyl-7-phenylthieno[3,2-b]pyridine-6-carbonitrile Traditional Name: 5-amino-3-(1H-benzimidazol-2-yl)-2-(phenacylthio)-7-phenyl-thieno[3,2-b]pyridine-6-carbonitrile Formula: C29H19N5OS2 MolecularWeight: 517.62406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC3=C2SC(=C3C4=NC5=CC=CC=C5N4)SCC(=O)C6=CC=CC=C6)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC3=C2SC(=C3C4=NC5=CC=CC=C5N4)SCC(=O)C6=CC=CC=C6)N)C#N

InChI

InChI=1S/C29H19N5OS2/c30-15-19-23(18-11-5-2-6-12-18)26-25(34-27(19)31)24(28-32-20-13-7-8-14-21(20)33-28)29(37-26)36-16-22(35)17-9-3-1-4-10-17/h1-14H,16H2,(H2,31,34)(H,32,33)