N-(3-methoxyphenyl)-6-methylsulfonyl-pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-methoxyphenyl)-6-methylsulfonyl-pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-6-methylsulfonyl-pyrimido[5,4-d]pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-6-methylsulfonyl-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-6-methylsulfonylpyrimido[5,4-d]pyrimidin-4-amine Traditional Name: (6-mesylpyrimido[5,4-d]pyrimidin-4-yl)-(3-methoxyphenyl)amine Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=NC3=CN=C(N=C32)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=NC3=CN=C(N=C32)S(=O)(=O)C

InChI

InChI=1S/C14H13N5O3S/c1-22-10-5-3-4-9(6-10)18-13-12-11(16-8-17-13)7-15-14(19-12)23(2,20)21/h3-8H,1-2H3,(H,16,17,18)