3-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methoxy]benzenecarbonitrile

Systemtic Name: 3-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methoxy]benzenecarbonitrile Openeye Name: 3-[(1-methyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)methoxy]benzonitrile CAS Name: 3-[[1-methyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]methoxy]benzonitrile IUPAC Name: 3-[(1-methyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)methoxy]benzonitrile Traditional Name: 3-[(1-methyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)methoxy]benzonitrile Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1COC4=CC=CC(=C4)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1COC4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H20N4O3S/c1-23-19-8-7-17(28(25,26)24-9-2-3-10-24)12-18(19)22-20(23)14-27-16-6-4-5-15(11-16)13-21/h4-8,11-12H,2-3,9-10,14H2,1H3