1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)urea

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)urea Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)urea CAS Name: 1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)urea IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)urea Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)urea Formula: C22H16FN3O3S MolecularWeight: 421.444143

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)NC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)NC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)F

InChI

InChI=1S/C22H16FN3O3S/c23-15-9-14-11-28-12-29-20(14)18(10-15)26-22(27)24-16-7-5-13(6-8-16)21-25-17-3-1-2-4-19(17)30-21/h1-10H,11-12H2,(H2,24,26,27)