2-ethanimidoyl-3-oxidanylidene-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxybutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy-butyronitrile Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3

InChI

InChI=1S/C18H14N4O2S/c1-11(20)13(7-19)15(23)8-24-17-16-14(12-5-3-2-4-6-12)9-25-18(16)22-10-21-17/h2-6,9-10,13,20H,8H2,1H3