N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-tosyl-piperazine-1-carboxamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H23N3O5S/c1-15-2-5-17(6-3-15)29(25,26)23-10-8-22(9-11-23)20(24)21-16-4-7-18-19(14-16)28-13-12-27-18/h2-7,14H,8-13H2,1H3,(H,21,24)