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

Systemtic Name: 2-ethanimidoyl-4-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]butyronitrile Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

InChI

InChI=1S/C19H16N4O2S2/c1-11(21)13(8-20)15(24)10-27-19-22-17-16(18(25)23(19)2)14(9-26-17)12-6-4-3-5-7-12/h3-7,9,13,21H,10H2,1-2H3