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

Systemtic Name: 3-[(Z)-2-chloranyl-2-(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 3-[(Z)-2-chloro-2-(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)vinyl]benzonitrile CAS Name: 3-[(Z)-2-chloro-2-[5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]ethenyl]benzonitrile IUPAC Name: 3-[(Z)-2-chloro-2-(5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)ethenyl]benzonitrile Traditional Name: 3-[(Z)-2-chloro-2-(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)vinyl]benzonitrile Formula: C23H23ClN4O3S MolecularWeight: 470.97172

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C(=CC4=CC=CC(=C4)C#N)Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1/C(=C/C4=CC=CC(=C4)C#N)/Cl

InChI

InChI=1S/C23H23ClN4O3S/c1-2-8-28-22-7-6-19(32(29,30)27-9-11-31-12-10-27)15-21(22)26-23(28)20(24)14-17-4-3-5-18(13-17)16-25/h3-7,13-15H,2,8-12H2,1H3/b20-14-