2-[(3-cyanophenyl)sulfonyl-methyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-[(3-cyanophenyl)sulfonyl-methyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-[(3-cyanophenyl)sulfonyl-methyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-[(3-cyanophenyl)sulfonyl-methylamino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-[(3-cyanophenyl)sulfonyl-methylamino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-[(3-cyanophenyl)sulfonyl-methyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN(CC(=O)NC1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H17N3O5S/c1-21(27(23,24)15-4-2-3-13(9-15)11-19)12-18(22)20-14-5-6-16-17(10-14)26-8-7-25-16/h2-6,9-10H,7-8,12H2,1H3,(H,20,22)