6-methylsulfinyl-N-[4-(phenylmethyl)phenyl]pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: 6-methylsulfinyl-N-[4-(phenylmethyl)phenyl]pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(4-benzylphenyl)-6-methylsulfinyl-pyrimido[5,4-d]pyrimidin-4-amine CAS Name: 6-methylsulfinyl-N-[4-(phenylmethyl)phenyl]-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(4-benzylphenyl)-6-methylsulfinylpyrimido[5,4-d]pyrimidin-4-amine Traditional Name: (4-benzylphenyl)-(6-methylsulfinylpyrimido[5,4-d]pyrimidin-4-yl)amine Formula: C20H17N5OS MolecularWeight: 375.44688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=NC=C2C(=N1)C(=NC=N2)NC3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)C1=NC=C2C(=N1)C(=NC=N2)NC3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H17N5OS/c1-27(26)20-21-12-17-18(25-20)19(23-13-22-17)24-16-9-7-15(8-10-16)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H,22,23,24)