4-cyclohexyl-5-[2-[[3-[3-(2-methoxyethylamino)propoxy]phenyl]amino]pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile

Systemtic Name: 4-cyclohexyl-5-[2-[[3-[3-(2-methoxyethylamino)propoxy]phenyl]amino]pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile Openeye Name: 4-cyclohexyl-5-[2-[3-[3-(2-methoxyethylamino)propoxy]anilino]pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile CAS Name: 4-cyclohexyl-5-[2-[3-[3-(2-methoxyethylamino)propoxy]anilino]-4-pyrimidinyl]-2-(methylthio)-3-thiophenecarbonitrile IUPAC Name: 4-cyclohexyl-5-[2-[3-[3-(2-methoxyethylamino)propoxy]anilino]pyrimidin-4-yl]-2-methylsulfanylthiophene-3-carbonitrile Traditional Name: 4-cyclohexyl-5-[2-[3-[3-(2-methoxyethylamino)propoxy]anilino]pyrimidin-4-yl]-2-(methylthio)thiophene-3-carbonitrile Formula: C28H35N5O2S2 MolecularWeight: 537.7398

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Descriptors Computed from Structure

Canonical SMILES:

COCCNCCCOC1=CC=CC(=C1)NC2=NC=CC(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4

Isomeric SMILES

COCCNCCCOC1=CC=CC(=C1)NC2=NC=CC(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4

InChI

InChI=1S/C28H35N5O2S2/c1-34-17-15-30-13-7-16-35-22-11-6-10-21(18-22)32-28-31-14-12-24(33-28)26-25(20-8-4-3-5-9-20)23(19-29)27(36-2)37-26/h6,10-12,14,18,20,30H,3-5,7-9,13,15-17H2,1-2H3,(H,31,32,33)