4-(1H-benzimidazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[(4-morpholinosulfonylphenyl)methyl]butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(4-morpholinosulfonylbenzyl)butyramide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H26N4O4S2/c27-21(6-3-15-31-22-24-19-4-1-2-5-20(19)25-22)23-16-17-7-9-18(10-8-17)32(28,29)26-11-13-30-14-12-26/h1-2,4-5,7-10H,3,6,11-16H2,(H,23,27)(H,24,25)