2-(benzimidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(benzimidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-(benzimidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)oxazole-4-carboxamide CAS Name: 2-(1-benzimidazolylmethyl)-N-[3-(methylthio)propyl]-4-oxazolecarboxamide IUPAC Name: 2-(benzimidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-(benzimidazol-1-ylmethyl)-N-[3-(methylthio)propyl]oxazole-4-carboxamide Formula: C16H18N4O2S MolecularWeight: 330.40472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=O)C1=COC(=N1)CN2C=NC3=CC=CC=C32

Isomeric SMILES

CSCCCNC(=O)C1=COC(=N1)CN2C=NC3=CC=CC=C32

InChI

InChI=1S/C16H18N4O2S/c1-23-8-4-7-17-16(21)13-10-22-15(19-13)9-20-11-18-12-5-2-3-6-14(12)20/h2-3,5-6,10-11H,4,7-9H2,1H3,(H,17,21)