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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=C(C=C3)OC)SCC#N)C

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=C(C=C3)OC)SCC#N)C

InChI

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