2-[4-(1,3-benzodioxol-5-yl)-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-yl)-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-yl)-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-2-imidazolyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-yl)-1-phenylimidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-imidazol-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C25H21N3O4S MolecularWeight: 459.51694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O4S/c1-30-20-10-8-18(9-11-20)26-24(29)15-33-25-27-21(14-28(25)19-5-3-2-4-6-19)17-7-12-22-23(13-17)32-16-31-22/h2-14H,15-16H2,1H3,(H,26,29)