2-chloranyl-8-methylsulfanyl-N-phenethyl-pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: 2-chloranyl-8-methylsulfanyl-N-phenethyl-pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: 2-chloro-8-methylsulfanyl-N-phenethyl-pyrimido[5,4-d]pyrimidin-4-amine CAS Name: 2-chloro-8-(methylthio)-N-phenethyl-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: 2-chloro-8-methylsulfanyl-N-phenethylpyrimido[5,4-d]pyrimidin-4-amine Traditional Name: [2-chloro-8-(methylthio)pyrimido[5,4-d]pyrimidin-4-yl]-phenethyl-amine Formula: C15H14ClN5S MolecularWeight: 331.82316

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC2=C1N=C(N=C2NCCC3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NC=NC2=C1N=C(N=C2NCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C15H14ClN5S/c1-22-14-12-11(18-9-19-14)13(21-15(16)20-12)17-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,17,20,21)