3-methylbutyl 2-[2-methyl-4-oxidanylidene-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-5-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[2-methyl-4-oxidanylidene-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-5-yl]ethanoate Openeye Name: isopentyl 2-[2-methyl-4-oxo-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-5-yl]acetate CAS Name: 2-[2-methyl-4-oxo-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-5-yl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[2-methyl-4-oxo-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-5-yl]acetate Traditional Name: 2-[4-keto-2-methyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-5-yl]acetic acid isoamyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CN=CC=C2)CC(=O)OCCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CN=CC=C2)CC(=O)OCCC(C)C

InChI

InChI=1S/C19H23N3O3/c1-13(2)8-10-25-18(23)11-16-17(21-14(3)22-19(16)24)7-6-15-5-4-9-20-12-15/h4-7,9,12-13H,8,10-11H2,1-3H3,(H,21,22,24)/b7-6+