1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[2-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-morpholinosulfonylbenzyl)urea Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H25N3O6S/c25-21(23-14-17-15-29-18-6-2-3-7-19(18)30-17)22-13-16-5-1-4-8-20(16)31(26,27)24-9-11-28-12-10-24/h1-8,17H,9-15H2,(H2,22,23,25)