N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(5-chloro-2-methoxy-phenyl)acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(5-chloro-2-methoxyphenyl)acetamide Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-N-(5-chloro-2-methoxy-phenyl)acetamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

InChI

InChI=1S/C20H20ClN3O3S/c1-27-18-8-7-15(21)9-17(18)23-19(26)13-28-20-22-16(12-25)11-24(20)10-14-5-3-2-4-6-14/h2-9,11,25H,10,12-13H2,1H3,(H,23,26)