N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C20H18BrN3O4S MolecularWeight: 476.34362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C20H18BrN3O4S/c1-26-14-4-2-3-13(9-14)24-6-5-22-20(24)29-12-19(25)23-16-11-18-17(10-15(16)21)27-7-8-28-18/h2-6,9-11H,7-8,12H2,1H3,(H,23,25)