5-but-1-ynyl-4-methyl-2-methylsulfanyl-pyrimidine

Systemtic Name: 5-but-1-ynyl-4-methyl-2-methylsulfanyl-pyrimidine Openeye Name: 5-but-1-ynyl-4-methyl-2-methylsulfanyl-pyrimidine CAS Name: 5-but-1-ynyl-4-methyl-2-(methylthio)pyrimidine IUPAC Name: 5-but-1-ynyl-4-methyl-2-methylsulfanylpyrimidine Traditional Name: 5-but-1-ynyl-4-methyl-2-(methylthio)pyrimidine Formula: C10H12N2S MolecularWeight: 192.28068

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=CN=C(N=C1C)SC

Isomeric SMILES

CCC#CC1=CN=C(N=C1C)SC

InChI

InChI=1S/C10H12N2S/c1-4-5-6-9-7-11-10(13-3)12-8(9)2/h7H,4H2,1-3H3