N-[2,6-bis(chloranyl)phenyl]-2-(cyclohexylcarbonylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2,6-bis(chloranyl)phenyl]-2-(cyclohexylcarbonylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclohexanecarbonylamino)-N-(2,6-dichlorophenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-N-(2,6-dichlorophenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclohexanecarbonylamino)-N-(2,6-dichlorophenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclohexanecarbonylamino)-N-(2,6-dichlorophenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H19Cl2N3O2S MolecularWeight: 448.36546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O2S/c22-14-7-4-8-15(23)18(14)25-20(28)13-9-10-16-17(11-13)29-21(24-16)26-19(27)12-5-2-1-3-6-12/h4,7-12H,1-3,5-6H2,(H,25,28)(H,24,26,27)