4-[[4-(ethylamino)-2-[[1-(phenylmethyl)indol-5-yl]amino]pyrimidin-5-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[4-(ethylamino)-2-[[1-(phenylmethyl)indol-5-yl]amino]pyrimidin-5-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[2-[(1-benzylindol-5-yl)amino]-4-(ethylamino)pyrimidin-5-yl]amino]cyclohexanol CAS Name: 4-[[4-(ethylamino)-2-[[1-(phenylmethyl)-5-indolyl]amino]-5-pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[2-[(1-benzylindol-5-yl)amino]-4-(ethylamino)pyrimidin-5-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[2-[(1-benzylindol-5-yl)amino]-4-(ethylamino)pyrimidin-5-yl]amino]cyclohexanol Formula: C27H32N6O MolecularWeight: 456.58258

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC=C1NC2CCC(CC2)O)NC3=CC4=C(C=C3)N(C=C4)CC5=CC=CC=C5

Isomeric SMILES

CCNC1=NC(=NC=C1NC2CCC(CC2)O)NC3=CC4=C(C=C3)N(C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H32N6O/c1-2-28-26-24(30-21-8-11-23(34)12-9-21)17-29-27(32-26)31-22-10-13-25-20(16-22)14-15-33(25)18-19-6-4-3-5-7-19/h3-7,10,13-17,21,23,30,34H,2,8-9,11-12,18H2,1H3,(H2,28,29,31,32)