butyl 2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: butyl 2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoate Openeye Name: butyl 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]acetic acid butyl ester Formula: C12H15N3O2S2 MolecularWeight: 297.3964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC(=C2C=CSC2=N1)N

Isomeric SMILES

CCCCOC(=O)CSC1=NC(=C2C=CSC2=N1)N

InChI

InChI=1S/C12H15N3O2S2/c1-2-3-5-17-9(16)7-19-12-14-10(13)8-4-6-18-11(8)15-12/h4,6H,2-3,5,7H2,1H3,(H2,13,14,15)