N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-[N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-(N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-(N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-(N-tosylanilino)propionamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N(C)CC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N(C)CC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O5S/c1-20-8-11-23(12-9-20)34(30,31)28(22-6-4-3-5-7-22)15-14-26(29)27(2)19-21-10-13-24-25(18-21)33-17-16-32-24/h3-13,18H,14-17,19H2,1-2H3