N-[2-[5-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]ethyl]methanesulfonamide

Systemtic Name: N-[2-[5-[2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]ethyl]methanesulfonamide Openeye Name: N-[2-[5-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylacetyl]-2-thienyl]ethyl]methanesulfonamide CAS Name: N-[2-[5-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-thiophenyl]ethyl]methanesulfonamide IUPAC Name: N-[2-[5-[2-(4-amino-5-cyanopyrimidin-2-yl)sulfanylacetyl]thiophen-2-yl]ethyl]methanesulfonamide Traditional Name: N-[2-[5-[2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]acetyl]-2-thienyl]ethyl]methanesulfonamide Formula: C14H15N5O3S3 MolecularWeight: 397.4956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H15N5O3S3/c1-25(21,22)18-5-4-10-2-3-12(24-10)11(20)8-23-14-17-7-9(6-15)13(16)19-14/h2-3,7,18H,4-5,8H2,1H3,(H2,16,17,19)