4-[[5-(2-dimethylaminoethylsulfonyl)-1-methyl-benzimidazol-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(2-dimethylaminoethylsulfonyl)-1-methyl-benzimidazol-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-(2-dimethylaminoethylsulfonyl)-1-methyl-benzimidazol-2-yl]methyl]benzonitrile CAS Name: 4-[[5-(2-dimethylaminoethylsulfonyl)-1-methyl-2-benzimidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-(2-dimethylaminoethylsulfonyl)-1-methylbenzimidazol-2-yl]methyl]benzonitrile Traditional Name: 4-[[5-(2-dimethylaminoethylsulfonyl)-1-methyl-benzimidazol-2-yl]methyl]benzonitrile Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCN(C)C)N=C1CC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCN(C)C)N=C1CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H22N4O2S/c1-23(2)10-11-27(25,26)17-8-9-19-18(13-17)22-20(24(19)3)12-15-4-6-16(14-21)7-5-15/h4-9,13H,10-12H2,1-3H3