1,3-benzothiazol-2-ylmethyl 2-(6-methyl-4-oxidanylidene-2-pyridin-2-yl-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(6-methyl-4-oxidanylidene-2-pyridin-2-yl-1H-pyrimidin-5-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[6-methyl-4-oxo-2-(2-pyridyl)-1H-pyrimidin-5-yl]acetate CAS Name: 2-[6-methyl-4-oxo-2-(2-pyridinyl)-1H-pyrimidin-5-yl]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(6-methyl-4-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetate Traditional Name: 2-[4-keto-6-methyl-2-(2-pyridyl)-1H-pyrimidin-5-yl]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC=CC=N2)CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC=CC=N2)CC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N4O3S/c1-12-13(20(26)24-19(22-12)15-7-4-5-9-21-15)10-18(25)27-11-17-23-14-6-2-3-8-16(14)28-17/h2-9H,10-11H2,1H3,(H,22,24,26)