N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(thiophen-2-ylsulfonylamino)benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(2-thienylsulfonylamino)benzamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(2-thienylsulfonylamino)benzamide Formula: C22H22N4O3S3 MolecularWeight: 486.63008

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N4O3S3/c1-30-13-11-19(21-23-17-8-2-3-9-18(17)24-21)25-22(27)15-6-4-7-16(14-15)26-32(28,29)20-10-5-12-31-20/h2-10,12,14,19,26H,11,13H2,1H3,(H,23,24)(H,25,27)/t19-/m0/s1