(2S)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: (2S)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: (2S)-4-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: (2S)-4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: (2S)-2-acetimidoyl-4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-3-keto-butyronitrile Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)[C@H](C#N)C(=N)C)C

InChI

InChI=1S/C14H14N4OS2/c1-7-9(3)21-14-12(7)13(17-6-18-14)20-5-11(19)10(4-15)8(2)16/h6,10,16H,5H2,1-3H3/t10-/m1/s1