3-(3-methyl-1,2-benzothiazol-5-yl)-2-prop-2-enoxy-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-2-prop-2-enoxy-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-allyloxy-3-(3-methyl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-2-prop-2-enoxy-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-(3-methyl-1,2-benzothiazol-5-yl)-2-prop-2-enoxy-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-allyloxy-3-(3-methyl-1,2-benzothiazol-5-yl)-6-(trifluoromethyl)pyrimidin-4-one Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N=C3OCC=C)C(F)(F)F

Isomeric SMILES

CC1=NSC2=C1C=C(C=C2)N3C(=O)C=C(N=C3OCC=C)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S/c1-3-6-24-15-20-13(16(17,18)19)8-14(23)22(15)10-4-5-12-11(7-10)9(2)21-25-12/h3-5,7-8H,1,6H2,2H3