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

Systemtic Name: (2S)-2-ethanimidoyl-4-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2S)-2-ethanimidoyl-3-oxo-4-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-butanenitrile CAS Name: (2S)-2-(1-iminoethyl)-4-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]-3-oxobutanenitrile IUPAC Name: (2S)-2-ethanimidoyl-4-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-3-oxobutanenitrile Traditional Name: (2S)-2-acetimidoyl-3-keto-4-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]butyronitrile Formula: C19H16N4OS2 MolecularWeight: 380.48654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)[C@H](C#N)C(=N)C

InChI

InChI=1S/C19H16N4OS2/c1-11-3-5-13(6-4-11)15-8-25-18-17(15)19(23-10-22-18)26-9-16(24)14(7-20)12(2)21/h3-6,8,10,14,21H,9H2,1-2H3/t14-/m1/s1