(2S)-2-[(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile

Systemtic Name: (2S)-2-[(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile Openeye Name: (2S)-2-[(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile CAS Name: (2S)-2-[(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)methyl]pentanedinitrile IUPAC Name: (2S)-2-[(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile Traditional Name: (2S)-2-[(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]glutaronitrile Formula: C18H14N4OS MolecularWeight: 334.39496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN(C3=O)CC(CCC#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN(C3=O)C[C@H](CCC#N)C#N

InChI

InChI=1S/C18H14N4OS/c19-8-4-5-13(10-20)11-22-12-21-17-15(18(22)23)9-16(24-17)14-6-2-1-3-7-14/h1-3,6-7,9,12-13H,4-5,11H2/t13-/m1/s1