N-(1-phenylbutyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1-phenylbutyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1-phenylbutyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1-phenylbutyl)-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(1-phenylbutyl)-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1-phenylbutyl)-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]propionamide Formula: C23H30N4O3S2 MolecularWeight: 474.6393

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=C(N2CCC)C=CC(=C3)S(=O)(=O)N

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=C(N2CCC)C=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C23H30N4O3S2/c1-4-9-19(17-10-7-6-8-11-17)25-22(28)16(3)31-23-26-20-15-18(32(24,29)30)12-13-21(20)27(23)14-5-2/h6-8,10-13,15-16,19H,4-5,9,14H2,1-3H3,(H,25,28)(H2,24,29,30)