2-[3-(2-methylphenyl)-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[3-(2-methylphenyl)-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[3-(o-tolyl)-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[3-(2-methylphenyl)-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[3-(2-methylphenyl)-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[4-keto-3-(o-tolyl)-5-phenyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetonitrile Formula: C21H15N3OS2 MolecularWeight: 389.4933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC#N)SC=C3C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC#N)SC=C3C4=CC=CC=C4

InChI

InChI=1S/C21H15N3OS2/c1-14-7-5-6-10-17(14)24-20(25)18-16(15-8-3-2-4-9-15)13-27-19(18)23-21(24)26-12-11-22/h2-10,13H,12H2,1H3