3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)benzenecarbonitrile

Systemtic Name: 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)benzenecarbonitrile Openeye Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)benzonitrile CAS Name: 3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]benzonitrile IUPAC Name: 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)benzonitrile Traditional Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)benzonitrile Formula: C20H20N4O3S MolecularWeight: 396.4628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C4=CC=CC(=C4)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H20N4O3S/c1-2-24-19-7-6-17(28(25,26)23-8-10-27-11-9-23)13-18(19)22-20(24)16-5-3-4-15(12-16)14-21/h3-7,12-13H,2,8-11H2,1H3