11-(1H-benzimidazol-2-ylsulfanyl)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile

Systemtic Name: 11-(1H-benzimidazol-2-ylsulfanyl)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Openeye Name: 11-(1H-benzimidazol-2-ylsulfanyl)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile CAS Name: 11-(1H-benzimidazol-2-ylthio)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile IUPAC Name: 11-(1H-benzimidazol-2-ylsulfanyl)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Traditional Name: 11-(1H-benzimidazol-2-ylthio)-7,8,9,10-tetrahydrobenzimidazol[1,2-b]isoquinoline-6-carbonitrile Formula: C23H17N5S MolecularWeight: 395.47958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N3C4=CC=CC=C4N=C3C(=C2C1)C#N)SC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1CCC2=C(N3C4=CC=CC=C4N=C3C(=C2C1)C#N)SC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C23H17N5S/c24-13-16-14-7-1-2-8-15(14)22(28-20-12-6-5-11-19(20)25-21(16)28)29-23-26-17-9-3-4-10-18(17)27-23/h3-6,9-12H,1-2,7-8H2,(H,26,27)