4-cyclohexyl-5-[2-[(3,5-dimethoxyphenyl)amino]pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile

Systemtic Name: 4-cyclohexyl-5-[2-[(3,5-dimethoxyphenyl)amino]pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile Openeye Name: 4-cyclohexyl-5-[2-(3,5-dimethoxyanilino)pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile CAS Name: 4-cyclohexyl-5-[2-(3,5-dimethoxyanilino)-4-pyrimidinyl]-2-(methylthio)-3-thiophenecarbonitrile IUPAC Name: 4-cyclohexyl-5-[2-(3,5-dimethoxyanilino)pyrimidin-4-yl]-2-methylsulfanylthiophene-3-carbonitrile Traditional Name: 4-cyclohexyl-5-[2-(3,5-dimethoxyanilino)pyrimidin-4-yl]-2-(methylthio)thiophene-3-carbonitrile Formula: C24H26N4O2S2 MolecularWeight: 466.61884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4)OC

InChI

InChI=1S/C24H26N4O2S2/c1-29-17-11-16(12-18(13-17)30-2)27-24-26-10-9-20(28-24)22-21(15-7-5-4-6-8-15)19(14-25)23(31-3)32-22/h9-13,15H,4-8H2,1-3H3,(H,26,27,28)