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

Systemtic Name: 2-[[5-(4-methoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]pentanedinitrile Openeye Name: 2-[[5-(4-methoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]pentanedinitrile CAS Name: 2-[[5-(4-methoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]methyl]pentanedinitrile IUPAC Name: 2-[[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-keto-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]methyl]glutaronitrile Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(CCC#N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(CCC#N)C#N

InChI

InChI=1S/C19H16N4O2S/c1-25-15-6-4-14(5-7-15)16-11-26-18-17(16)19(24)23(12-22-18)10-13(9-21)3-2-8-20/h4-7,11-13H,2-3,10H2,1H3