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

Systemtic Name: 1-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)urea Openeye Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)urea CAS Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-(5-chloro-2,4-dimethoxyphenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)urea Traditional Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-(6-mesyl-1,3-benzothiazol-2-yl)urea Formula: C17H16ClN3O5S2 MolecularWeight: 441.90904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)Cl)OC

InChI

InChI=1S/C17H16ClN3O5S2/c1-25-13-8-14(26-2)12(7-10(13)18)19-16(22)21-17-20-11-5-4-9(28(3,23)24)6-15(11)27-17/h4-8H,1-3H3,(H2,19,20,21,22)