1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(phenylsulfonylamino)-1,3-benzothiazol-5-yl]urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(phenylsulfonylamino)-1,3-benzothiazol-5-yl]urea Openeye Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-5-yl]-3-(3-chloro-4-fluoro-phenyl)urea CAS Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-5-yl]-3-(3-chloro-4-fluorophenyl)urea IUPAC Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-5-yl]-3-(3-chloro-4-fluorophenyl)urea Traditional Name: 1-[2-(benzenesulfonamido)-1,3-benzothiazol-5-yl]-3-(3-chloro-4-fluoro-phenyl)urea Formula: C20H14ClFN4O3S2 MolecularWeight: 476.931563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H14ClFN4O3S2/c21-15-10-12(6-8-16(15)22)23-19(27)24-13-7-9-18-17(11-13)25-20(30-18)26-31(28,29)14-4-2-1-3-5-14/h1-11H,(H,25,26)(H2,23,24,27)