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

Systemtic Name: (2R)-2-ethanimidoyl-4-(3-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2R)-2-ethanimidoyl-4-(3-ethyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: (2R)-4-[(3-ethyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: (2R)-2-ethanimidoyl-4-(3-ethyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: (2R)-2-acetimidoyl-4-[(3-ethyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-3-keto-butyronitrile Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC(=O)C(C#N)C(=N)C)SC=C2C3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC(=O)[C@@H](C#N)C(=N)C)SC=C2C3=CC=CC=C3

InChI

InChI=1S/C20H18N4O2S2/c1-3-24-19(26)17-15(13-7-5-4-6-8-13)10-27-18(17)23-20(24)28-11-16(25)14(9-21)12(2)22/h4-8,10,14,22H,3,11H2,1-2H3/t14-/m0/s1