N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]-1-tosyl-isonipecotamide Formula: C26H33N3O6S MolecularWeight: 515.62172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C26H33N3O6S/c1-17(2)24(26(31)27-20-6-9-22-23(16-20)35-15-14-34-22)28-25(30)19-10-12-29(13-11-19)36(32,33)21-7-4-18(3)5-8-21/h4-9,16-17,19,24H,10-15H2,1-3H3,(H,27,31)(H,28,30)