(2R)-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanamide

Systemtic Name: (2R)-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanamide Openeye Name: (2R)-N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-2-(4-ethoxy-N-methylsulfonyl-anilino)propanamide CAS Name: (2R)-N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide IUPAC Name: (2R)-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide Traditional Name: (2R)-2-(4-ethoxy-N-mesyl-anilino)-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)propionamide Formula: C21H26N4O5S MolecularWeight: 446.51994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N([C@H](C)C(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C)S(=O)(=O)C

InChI

InChI=1S/C21H26N4O5S/c1-6-30-17-10-8-16(9-11-17)25(31(5,28)29)14(2)20(26)22-15-7-12-18-19(13-15)24(4)21(27)23(18)3/h7-14H,6H2,1-5H3,(H,22,26)/t14-/m1/s1