3-methyl-4-[(4-methylphenyl)methylsulfanyl]-[1,2]oxazolo[5,4-d]pyrimidine

Systemtic Name: 3-methyl-4-[(4-methylphenyl)methylsulfanyl]-[1,2]oxazolo[5,4-d]pyrimidine Openeye Name: 3-methyl-4-(p-tolylmethylsulfanyl)isoxazolo[5,4-d]pyrimidine CAS Name: 3-methyl-4-[(4-methylphenyl)methylthio]isoxazolo[5,4-d]pyrimidine IUPAC Name: 3-methyl-4-[(4-methylphenyl)methylsulfanyl]-[1,2]oxazolo[5,4-d]pyrimidine Traditional Name: 3-methyl-4-[(4-methylbenzyl)thio]isoxazolo[5,4-d]pyrimidine Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=NC3=C2C(=NO3)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=NC3=C2C(=NO3)C

InChI

InChI=1S/C14H13N3OS/c1-9-3-5-11(6-4-9)7-19-14-12-10(2)17-18-13(12)15-8-16-14/h3-6,8H,7H2,1-2H3