2-[5-ethyl-3-(4-methoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[5-ethyl-3-(4-methoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[5-ethyl-3-(4-methoxyphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[5-ethyl-3-(4-methoxyphenyl)-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[5-ethyl-3-(4-methoxyphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[5-ethyl-4-keto-3-(4-methoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetonitrile Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC#N)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC#N)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H17N3O2S2/c1-4-14-11(2)25-16-15(14)17(22)21(18(20-16)24-10-9-19)12-5-7-13(23-3)8-6-12/h5-8H,4,10H2,1-3H3