4-chloranyl-5-methoxy-2-(phenylmethylsulfanyl)pyrimidine

Systemtic Name: 4-chloranyl-5-methoxy-2-(phenylmethylsulfanyl)pyrimidine Openeye Name: 2-benzylsulfanyl-4-chloro-5-methoxy-pyrimidine CAS Name: 4-chloro-5-methoxy-2-(phenylmethylthio)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-chloro-5-methoxypyrimidine Traditional Name: 2-(benzylthio)-4-chloro-5-methoxy-pyrimidine Formula: C12H11ClN2OS MolecularWeight: 266.74654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(N=C1Cl)SCC2=CC=CC=C2

Isomeric SMILES

COC1=CN=C(N=C1Cl)SCC2=CC=CC=C2

InChI

InChI=1S/C12H11ClN2OS/c1-16-10-7-14-12(15-11(10)13)17-8-9-5-3-2-4-6-9/h2-7H,8H2,1H3