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

Systemtic Name: 4-cyclohexyl-5-[2-[[3-(2-diethylaminoethylamino)phenyl]amino]-5-methyl-pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile Openeye Name: 4-cyclohexyl-5-[2-[3-(2-diethylaminoethylamino)anilino]-5-methyl-pyrimidin-4-yl]-2-methylsulfanyl-thiophene-3-carbonitrile CAS Name: 4-cyclohexyl-5-[2-[3-(2-diethylaminoethylamino)anilino]-5-methyl-4-pyrimidinyl]-2-(methylthio)-3-thiophenecarbonitrile IUPAC Name: 4-cyclohexyl-5-[2-[3-(2-diethylaminoethylamino)anilino]-5-methylpyrimidin-4-yl]-2-methylsulfanylthiophene-3-carbonitrile Traditional Name: 4-cyclohexyl-5-[2-[3-(2-diethylaminoethylamino)anilino]-5-methyl-pyrimidin-4-yl]-2-(methylthio)thiophene-3-carbonitrile Formula: C29H38N6S2 MolecularWeight: 534.78222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=CC=CC(=C1)NC2=NC=C(C(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4)C

Isomeric SMILES

CCN(CC)CCNC1=CC=CC(=C1)NC2=NC=C(C(=N2)C3=C(C(=C(S3)SC)C#N)C4CCCCC4)C

InChI

InChI=1S/C29H38N6S2/c1-5-35(6-2)16-15-31-22-13-10-14-23(17-22)33-29-32-19-20(3)26(34-29)27-25(21-11-8-7-9-12-21)24(18-30)28(36-4)37-27/h10,13-14,17,19,21,31H,5-9,11-12,15-16H2,1-4H3,(H,32,33,34)