1-(1,3-benzodioxol-5-yl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C24H23N3O5S MolecularWeight: 465.52152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H23N3O5S/c1-16-2-7-21(8-3-16)33(29,30)27-11-10-17-4-5-19(12-18(17)14-27)25-24(28)26-20-6-9-22-23(13-20)32-15-31-22/h2-9,12-13H,10-11,14-15H2,1H3,(H2,25,26,28)