N-[cyano(phenyl)methyl]-3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[cyano(phenyl)methyl]-3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-[cyano(phenyl)methyl]-3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanamide CAS Name: N-[cyano(phenyl)methyl]-3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-[cyano(phenyl)methyl]-3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-[cyano(phenyl)methyl]-3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)propionamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC(C#N)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC(C#N)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O4S/c1-2-29-22-9-8-19(34(31,32)28-12-14-33-15-13-28)16-20(22)26-23(29)10-11-24(30)27-21(17-25)18-6-4-3-5-7-18/h3-9,16,21H,2,10-15H2,1H3,(H,27,30)