N-methyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidin-4-amine

Systemtic Name: N-methyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidin-4-amine Openeye Name: N-methyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidin-4-amine CAS Name: N-methyl-2-(methylthio)-5-(3-phenylprop-1-ynyl)-4-pyrimidinamine IUPAC Name: N-methyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidin-4-amine Traditional Name: methyl-[2-(methylthio)-5-(3-phenylprop-1-ynyl)pyrimidin-4-yl]amine Formula: C15H15N3S MolecularWeight: 269.3647

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC=C1C#CCC2=CC=CC=C2)SC

Isomeric SMILES

CNC1=NC(=NC=C1C#CCC2=CC=CC=C2)SC

InChI

InChI=1S/C15H15N3S/c1-16-14-13(11-17-15(18-14)19-2)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,9H2,1-2H3,(H,16,17,18)