(2R)-N-methyl-N-(phenylmethyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-methyl-N-(phenylmethyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-benzyl-N-methyl-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-methyl-N-(phenylmethyl)-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-benzyl-N-methyl-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-benzyl-N-methyl-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]propionamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1S[C@H](C)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-4-12-25-19-11-10-17(30(22,27)28)13-18(19)23-21(25)29-15(2)20(26)24(3)14-16-8-6-5-7-9-16/h5-11,13,15H,4,12,14H2,1-3H3,(H2,22,27,28)/t15-/m1/s1