(2S)-2-[(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile

Systemtic Name: (2S)-2-[(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile Openeye Name: (2S)-2-[(5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile CAS Name: (2S)-2-[(5-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)methyl]pentanedinitrile IUPAC Name: (2S)-2-[(5-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)methyl]pentanedinitrile Traditional Name: (2S)-2-[(4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]glutaronitrile Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(CCC#N)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C[C@H](CCC#N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H16N4OS/c1-13-16-18(25-17(13)15-7-3-2-4-8-15)22-12-23(19(16)24)11-14(10-21)6-5-9-20/h2-4,7-8,12,14H,5-6,11H2,1H3/t14-/m1/s1