(2S)-2-ethanimidoyl-4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-2-ethanimidoyl-4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2S)-2-ethanimidoyl-4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-3-oxo-butanenitrile CAS Name: (2S)-2-(1-iminoethyl)-4-[(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: (2S)-2-ethanimidoyl-4-(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxobutanenitrile Traditional Name: (2S)-2-acetimidoyl-3-keto-4-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]thio]butyronitrile Formula: C17H14N4OS3 MolecularWeight: 386.51426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CS3)C(=N1)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CS3)C(=N1)SCC(=O)[C@H](C#N)C(=N)C

InChI

InChI=1S/C17H14N4OS3/c1-9(19)11(6-18)13(22)8-25-17-15-12(14-4-3-5-23-14)7-24-16(15)20-10(2)21-17/h3-5,7,11,19H,8H2,1-2H3/t11-/m1/s1