ethyl 2-[4-azanyl-5-(thiophen-2-ylmethyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-azanyl-5-(thiophen-2-ylmethyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-amino-5-(2-thienylmethyl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-amino-5-(thiophen-2-ylmethyl)-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-amino-5-(thiophen-2-ylmethyl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-amino-5-(2-thenyl)pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=C(C(=N1)N)CC2=CC=CS2

Isomeric SMILES

CCOC(=O)CSC1=NC=C(C(=N1)N)CC2=CC=CS2

InChI

InChI=1S/C13H15N3O2S2/c1-2-18-11(17)8-20-13-15-7-9(12(14)16-13)6-10-4-3-5-19-10/h3-5,7H,2,6,8H2,1H3,(H2,14,15,16)