N-[[5-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]methyl]ethanamide

Systemtic Name: N-[[5-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]methyl]ethanamide Openeye Name: N-[[5-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylacetyl]-2-thienyl]methyl]acetamide CAS Name: N-[[5-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-thiophenyl]methyl]acetamide IUPAC Name: N-[[5-[2-(4-amino-5-cyanopyrimidin-2-yl)sulfanylacetyl]thiophen-2-yl]methyl]acetamide Traditional Name: N-[[5-[2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]acetyl]-2-thienyl]methyl]acetamide Formula: C14H13N5O2S2 MolecularWeight: 347.41532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H13N5O2S2/c1-8(20)17-6-10-2-3-12(23-10)11(21)7-22-14-18-5-9(4-15)13(16)19-14/h2-3,5H,6-7H2,1H3,(H,17,20)(H2,16,18,19)