N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-3-fluoro-4-methyl-benzamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-5-yl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-3-fluoro-4-methylbenzamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-3-fluoro-4-methyl-benzamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C4CCCCC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C4CCCCC4)F

InChI

InChI=1S/C22H22FN3O2S/c1-13-7-8-15(11-17(13)23)21(28)24-16-9-10-19-18(12-16)25-22(29-19)26-20(27)14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3,(H,24,28)(H,25,26,27)