(2R)-N-(4-cyanophenyl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-cyanophenyl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-cyanophenyl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-cyanophenyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-N-(4-cyanophenyl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-cyanophenyl)-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]propionamide Formula: C23H25N5O4S2 MolecularWeight: 499.6057

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SC(C)C(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1S[C@H](C)C(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H25N5O4S2/c1-3-28-21-9-8-19(34(30,31)27-10-12-32-13-11-27)14-20(21)26-23(28)33-16(2)22(29)25-18-6-4-17(15-24)5-7-18/h4-9,14,16H,3,10-13H2,1-2H3,(H,25,29)/t16-/m1/s1