4-[(Z)-2-chloranyl-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-2-chloranyl-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(Z)-2-chloro-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)vinyl]benzonitrile CAS Name: 4-[(Z)-2-chloro-2-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]ethenyl]benzonitrile IUPAC Name: 4-[(Z)-2-chloro-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)ethenyl]benzonitrile Traditional Name: 4-[(Z)-2-chloro-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)vinyl]benzonitrile Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C(=CC4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1/C(=C/C4=CC=C(C=C4)C#N)/Cl

InChI

InChI=1S/C22H21ClN4O3S/c1-2-27-21-8-7-18(31(28,29)26-9-11-30-12-10-26)14-20(21)25-22(27)19(23)13-16-3-5-17(15-24)6-4-16/h3-8,13-14H,2,9-12H2,1H3/b19-13-