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

Systemtic Name: N-(2-methylsulfanylphenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-[2-(methylthio)phenyl]-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-[2-(methylthio)phenyl]-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]propionamide Formula: C20H24N4O3S3 MolecularWeight: 464.62456

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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)NC3=CC=CC=C3SC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C20H24N4O3S3/c1-4-11-24-17-10-9-14(30(21,26)27)12-16(17)23-20(24)29-13(2)19(25)22-15-7-5-6-8-18(15)28-3/h5-10,12-13H,4,11H2,1-3H3,(H,22,25)(H2,21,26,27)