1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea CAS Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Traditional Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Formula: C17H17ClN4O5S2 MolecularWeight: 456.92368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)NC2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)NC2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C)Cl)OC

InChI

InChI=1S/C17H17ClN4O5S2/c1-26-13-8-14(27-2)12(7-10(13)18)20-16(23)19-9-4-5-11-15(6-9)28-17(21-11)22-29(3,24)25/h4-8H,1-3H3,(H,21,22)(H2,19,20,23)