1-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(6-mesyl-1,3-benzothiazol-2-yl)thiourea Formula: C15H11ClFN3O2S3 MolecularWeight: 415.913143

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C15H11ClFN3O2S3/c1-25(21,22)9-3-5-12-13(7-9)24-15(19-12)20-14(23)18-8-2-4-11(17)10(16)6-8/h2-7H,1H3,(H2,18,19,20,23)