1-(1,3-benzodioxol-5-yl)-3-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]urea Openeye Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-(1,3-benzodioxol-5-yl)urea CAS Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-(1,3-benzodioxol-5-yl)urea IUPAC Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-(1,3-benzodioxol-5-yl)urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1-besyl-3,4-dihydro-2H-quinolin-7-yl)urea Formula: C23H21N3O5S MolecularWeight: 451.49494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCO4)N(C1)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCO4)N(C1)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H21N3O5S/c27-23(25-18-10-11-21-22(14-18)31-15-30-21)24-17-9-8-16-5-4-12-26(20(16)13-17)32(28,29)19-6-2-1-3-7-19/h1-3,6-11,13-14H,4-5,12,15H2,(H2,24,25,27)