2-ethylsulfanyl-N-(phenylmethyl)pyrimido[4,5-d]pyrimidin-5-amine

Systemtic Name: 2-ethylsulfanyl-N-(phenylmethyl)pyrimido[4,5-d]pyrimidin-5-amine Openeye Name: N-benzyl-2-ethylsulfanyl-pyrimido[4,5-d]pyrimidin-5-amine CAS Name: 2-(ethylthio)-N-(phenylmethyl)-5-pyrimido[4,5-d]pyrimidinamine IUPAC Name: N-benzyl-2-ethylsulfanylpyrimido[4,5-d]pyrimidin-5-amine Traditional Name: benzyl-[2-(ethylthio)pyrimido[4,5-d]pyrimidin-5-yl]amine Formula: C15H15N5S MolecularWeight: 297.3781

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C2C(=N1)N=CN=C2NCC3=CC=CC=C3

Isomeric SMILES

CCSC1=NC=C2C(=N1)N=CN=C2NCC3=CC=CC=C3

InChI

InChI=1S/C15H15N5S/c1-2-21-15-17-9-12-13(18-10-19-14(12)20-15)16-8-11-6-4-3-5-7-11/h3-7,9-10H,2,8H2,1H3,(H,16,17,18,19,20)