2-(1,3-benzoxazol-2-ylamino)-6-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-6-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimidin-4-one Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-6-(p-tolylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(1,3-benzoxazol-2-ylamino)-6-[[(4-methylphenyl)thio]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-6-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimidin-4-one Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-6-[(p-tolylthio)methyl]-1H-pyrimidin-4-one Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H16N4O2S/c1-12-6-8-14(9-7-12)26-11-13-10-17(24)22-18(20-13)23-19-21-15-4-2-3-5-16(15)25-19/h2-10H,11H2,1H3,(H2,20,21,22,23,24)