ethyl 4-(4-azanylpyrimidin-2-yl)sulfanylbutanoate

Systemtic Name: ethyl 4-(4-azanylpyrimidin-2-yl)sulfanylbutanoate Openeye Name: ethyl 4-(4-aminopyrimidin-2-yl)sulfanylbutanoate CAS Name: 4-[(4-amino-2-pyrimidinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-aminopyrimidin-2-yl)sulfanylbutanoate Traditional Name: 4-[(4-aminopyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C10H15N3O2S MolecularWeight: 241.31

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC=CC(=N1)N

Isomeric SMILES

CCOC(=O)CCCSC1=NC=CC(=N1)N

InChI

InChI=1S/C10H15N3O2S/c1-2-15-9(14)4-3-7-16-10-12-6-5-8(11)13-10/h5-6H,2-4,7H2,1H3,(H2,11,12,13)