N-(3-chloranyl-4-methoxy-phenyl)-6-methylsulfanyl-pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-6-methylsulfanyl-pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-6-methylsulfanyl-pyrimido[5,4-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-6-(methylthio)-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-6-methylsulfanylpyrimido[5,4-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[6-(methylthio)pyrimido[5,4-d]pyrimidin-4-yl]amine Formula: C14H12ClN5OS MolecularWeight: 333.79598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC3=CN=C(N=C32)SC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC3=CN=C(N=C32)SC)Cl

InChI

InChI=1S/C14H12ClN5OS/c1-21-11-4-3-8(5-9(11)15)19-13-12-10(17-7-18-13)6-16-14(20-12)22-2/h3-7H,1-2H3,(H,17,18,19)