N-butyl-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-4-amine

Systemtic Name: N-butyl-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-4-amine Openeye Name: N-butyl-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-4-amine CAS Name: N-butyl-2-(methylthio)-4-pyrido[2,3-d]pyrimidinamine IUPAC Name: N-butyl-2-methylsulfanylpyrido[2,3-d]pyrimidin-4-amine Traditional Name: butyl-[2-(methylthio)pyrido[2,3-d]pyrimidin-4-yl]amine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC2=C1C=CC=N2)SC

Isomeric SMILES

CCCCNC1=NC(=NC2=C1C=CC=N2)SC

InChI

InChI=1S/C12H16N4S/c1-3-4-7-13-10-9-6-5-8-14-11(9)16-12(15-10)17-2/h5-6,8H,3-4,7H2,1-2H3,(H,13,14,15,16)