N-(1,3-benzothiazol-2-yl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]acetamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=C2SCC(=O)NC3=NC4=CC=CC=C4S3)CO

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=C2SCC(=O)NC3=NC4=CC=CC=C4S3)CO

InChI

InChI=1S/C20H18N4O2S2/c25-12-15-11-24(10-14-6-2-1-3-7-14)20(21-15)27-13-18(26)23-19-22-16-8-4-5-9-17(16)28-19/h1-9,11,25H,10,12-13H2,(H,22,23,26)