2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Formula: C18H20FN5OS2 MolecularWeight: 405.512703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C18H20FN5OS2/c1-11-22-23-18(24(11)13-5-3-2-4-6-13)26-10-16(25)21-17-20-14-8-7-12(19)9-15(14)27-17/h7-9,13H,2-6,10H2,1H3,(H,20,21,25)