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

Systemtic Name: 3-[5-(2,4-dimethylphenyl)-2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanenitrile Openeye Name: 3-[5-(2,4-dimethylphenyl)-2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanenitrile CAS Name: 3-[5-(2,4-dimethylphenyl)-2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanenitrile IUPAC Name: 3-[5-(2,4-dimethylphenyl)-2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanenitrile Traditional Name: 3-[5-(2,4-dimethylphenyl)-4-keto-2-methyl-thieno[2,3-d]pyrimidin-3-yl]propionitrile Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CCC#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CCC#N)C

InChI

InChI=1S/C18H17N3OS/c1-11-5-6-14(12(2)9-11)15-10-23-17-16(15)18(22)21(8-4-7-19)13(3)20-17/h5-6,9-10H,4,8H2,1-3H3