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

Systemtic Name: 2-[5-(3-methoxyphenyl)-2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile Openeye Name: 2-[5-(3-methoxyphenyl)-2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetonitrile CAS Name: 2-[5-(3-methoxyphenyl)-2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile IUPAC Name: 2-[5-(3-methoxyphenyl)-2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetonitrile Traditional Name: 2-[4-keto-5-(3-methoxyphenyl)-2-methyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC(=CC=C3)OC)C(=O)N1CC#N

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC(=CC=C3)OC)C(=O)N1CC#N

InChI

InChI=1S/C16H13N3O2S/c1-10-18-15-14(16(20)19(10)7-6-17)13(9-22-15)11-4-3-5-12(8-11)21-2/h3-5,8-9H,7H2,1-2H3