2-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]ethanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]ethanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]acetyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]acetyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]acetyl]amino]-N-phenethyl-benzamide Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C26H27N3O6S/c1-36(32,33)29(20-11-12-23-24(17-20)35-16-15-34-23)18-25(30)28-22-10-6-5-9-21(22)26(31)27-14-13-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3,(H,27,31)(H,28,30)