4-methylsulfanyl-2-(phenylsulfonylamino)-N-(1-propylbenzimidazol-2-yl)butanamide

Systemtic Name: 4-methylsulfanyl-2-(phenylsulfonylamino)-N-(1-propylbenzimidazol-2-yl)butanamide Openeye Name: 2-(benzenesulfonamido)-4-methylsulfanyl-N-(1-propylbenzimidazol-2-yl)butanamide CAS Name: 2-(benzenesulfonamido)-4-(methylthio)-N-(1-propyl-2-benzimidazolyl)butanamide IUPAC Name: 2-(benzenesulfonamido)-4-methylsulfanyl-N-(1-propylbenzimidazol-2-yl)butanamide Traditional Name: 2-(benzenesulfonamido)-4-(methylthio)-N-(1-propylbenzimidazol-2-yl)butyramide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C(CCSC)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C(CCSC)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-3-14-25-19-12-8-7-11-17(19)22-21(25)23-20(26)18(13-15-29-2)24-30(27,28)16-9-5-4-6-10-16/h4-12,18,24H,3,13-15H2,1-2H3,(H,22,23,26)