N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(trifluoromethylsulfonyl)benzamide

Systemtic Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(trifluoromethylsulfonyl)benzamide Openeye Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(trifluoromethylsulfonyl)benzamide CAS Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(trifluoromethylsulfonyl)benzamide IUPAC Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(trifluoromethylsulfonyl)benzamide Traditional Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-triflyl-benzamide Formula: C16H15F3N2O3S2 MolecularWeight: 404.42711

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H15F3N2O3S2/c1-9-2-7-12-13(8-9)25-15(20-12)21-14(22)10-3-5-11(6-4-10)26(23,24)16(17,18)19/h3-6,9H,2,7-8H2,1H3,(H,20,21,22)