3-[3-(4-methoxyphenyl)-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[3-(4-methoxyphenyl)-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[3-(4-methoxyphenyl)-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[3-(4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]propanenitrile IUPAC Name: 3-[3-(4-methoxyphenyl)-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[4-keto-3-(4-methoxyphenyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]thio]propionitrile Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC#N)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC#N)C3=CC=C(C=C3)OC)C

InChI

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