1-[(3,4-dimethoxyphenyl)methyl]-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[(4-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[(4-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(4-morpholinosulfonylbenzyl)-3-veratryl-urea Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OC

InChI

InChI=1S/C21H27N3O6S/c1-28-19-8-5-17(13-20(19)29-2)15-23-21(25)22-14-16-3-6-18(7-4-16)31(26,27)24-9-11-30-12-10-24/h3-8,13H,9-12,14-15H2,1-2H3,(H2,22,23,25)