3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methyl-thiophen-2-yl]-5-(trifluoromethyl)-1,2-oxazole

Systemtic Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methyl-thiophen-2-yl]-5-(trifluoromethyl)-1,2-oxazole Openeye Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methyl-2-thienyl]-5-(trifluoromethyl)isoxazole CAS Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methyl-2-thiophenyl]-5-(trifluoromethyl)isoxazole IUPAC Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methylthiophen-2-yl]-5-(trifluoromethyl)-1,2-oxazole Traditional Name: 3-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methyl-2-thienyl]-5-(trifluoromethyl)isoxazole Formula: C18H15F3N2O3S2 MolecularWeight: 428.44851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=C(S1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C18H15F3N2O3S2/c1-11-16(9-15(27-11)14-8-17(26-22-14)18(19,20)21)28(24,25)23-7-6-12-4-2-3-5-13(12)10-23/h2-5,8-9H,6-7,10H2,1H3