N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide Formula: C18H16BrN3O5S MolecularWeight: 466.30574

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC2=C(C=C1Br)OCCO2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN(CC(=O)NC1=CC2=C(C=C1Br)OCCO2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H16BrN3O5S/c1-22(28(24,25)13-4-2-12(10-20)3-5-13)11-18(23)21-15-9-17-16(8-14(15)19)26-6-7-27-17/h2-5,8-9H,6-7,11H2,1H3,(H,21,23)