N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[[1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Traditional Name: 2-[(1-benzylimidazol-2-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O4S/c26-19(14-30-21-22-8-9-25(21)13-15-4-2-1-3-5-15)24-20(27)23-16-6-7-17-18(12-16)29-11-10-28-17/h1-9,12H,10-11,13-14H2,(H2,23,24,26,27)