N,N-bis(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N,N-bis(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(CCC#N)CCC#N)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(CCC#N)CCC#N)C

InChI

InChI=1S/C16H17N5OS2/c1-11-12(2)24-16-14(11)15(19-10-20-16)23-9-13(22)21(7-3-5-17)8-4-6-18/h10H,3-4,7-9H2,1-2H3