4-[[5-(1,3-dihydroisoindol-2-ylsulfonyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarbonitrile

Systemtic Name: 4-[[5-(1,3-dihydroisoindol-2-ylsulfonyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarbonitrile Openeye Name: 4-[(5-isoindolin-2-ylsulfonyl-1-methyl-benzimidazol-2-yl)methylamino]benzonitrile CAS Name: 4-[[5-(1,3-dihydroisoindol-2-ylsulfonyl)-1-methyl-2-benzimidazolyl]methylamino]benzonitrile IUPAC Name: 4-[[5-(1,3-dihydroisoindol-2-ylsulfonyl)-1-methylbenzimidazol-2-yl]methylamino]benzonitrile Traditional Name: 4-[(5-isoindolin-2-ylsulfonyl-1-methyl-benzimidazol-2-yl)methylamino]benzonitrile Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CC4=CC=CC=C4C3)N=C1CNC5=CC=C(C=C5)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CC4=CC=CC=C4C3)N=C1CNC5=CC=C(C=C5)C#N

InChI

InChI=1S/C24H21N5O2S/c1-28-23-11-10-21(32(30,31)29-15-18-4-2-3-5-19(18)16-29)12-22(23)27-24(28)14-26-20-8-6-17(13-25)7-9-20/h2-12,26H,14-16H2,1H3