3-[3-(2-methoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-1-prop-2-enyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-[3-(2-methoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-1-prop-2-enyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 1-allyl-3-[3-(2-methoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-[3-(2-methoxy-5-methylphenyl)-1,2-benzothiazol-5-yl]-1-prop-2-enyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-[3-(2-methoxy-5-methylphenyl)-1,2-benzothiazol-5-yl]-1-prop-2-enyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 1-allyl-3-[3-(2-methoxy-5-methyl-phenyl)-1,2-benzothiazol-5-yl]-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C23H18F3N3O3S MolecularWeight: 473.46753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)CC=C)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=NSC3=C2C=C(C=C3)N4C(=O)C=C(N(C4=O)CC=C)C(F)(F)F

InChI

InChI=1S/C23H18F3N3O3S/c1-4-9-28-19(23(24,25)26)12-20(30)29(22(28)31)14-6-8-18-16(11-14)21(27-33-18)15-10-13(2)5-7-17(15)32-3/h4-8,10-12H,1,9H2,2-3H3