N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Formula: C19H24N4O3S3 MolecularWeight: 452.61386

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(S3)CCNS(=O)(=O)C

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(S3)CCNS(=O)(=O)C

InChI

InChI=1S/C19H24N4O3S3/c1-27-12-10-16(18-21-14-5-3-4-6-15(14)22-18)23-19(24)17-8-7-13(28-17)9-11-20-29(2,25)26/h3-8,16,20H,9-12H2,1-2H3,(H,21,22)(H,23,24)/t16-/m0/s1