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

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(thiophen-2-ylsulfonylamino)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(2-thienylsulfonylamino)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(thiophen-2-ylsulfonylamino)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(thiophen-2-ylsulfonylamino)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(2-thienylsulfonylamino)propionamide Formula: C18H22N4O3S3 MolecularWeight: 438.58728

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N4O3S3/c1-26-12-9-15(18-21-13-5-2-3-6-14(13)22-18)20-16(23)8-10-19-28(24,25)17-7-4-11-27-17/h2-7,11,15,19H,8-10,12H2,1H3,(H,20,23)(H,21,22)