1-(1,3-benzodioxol-5-yl)-3-[2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-6-yl]-3-(1,3-benzodioxol-5-yl)urea CAS Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-6-yl]-3-(1,3-benzodioxol-5-yl)urea IUPAC Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-6-yl]-3-(1,3-benzodioxol-5-yl)urea Traditional Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-6-yl]-3-(1,3-benzodioxol-5-yl)urea Formula: C21H16N4O5S2 MolecularWeight: 468.50554

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O5S2/c26-20(22-13-7-9-17-18(10-13)30-12-29-17)23-14-6-8-16-19(11-14)31-21(24-16)25-32(27,28)15-4-2-1-3-5-15/h1-11H,12H2,(H,24,25)(H2,22,23,26)