4-[[2-azanyl-5-(4-ethylphenoxy)pyrimidin-4-yl]amino]cyclohexan-1-one

Systemtic Name: 4-[[2-azanyl-5-(4-ethylphenoxy)pyrimidin-4-yl]amino]cyclohexan-1-one Openeye Name: 4-[[2-amino-5-(4-ethylphenoxy)pyrimidin-4-yl]amino]cyclohexanone CAS Name: 4-[[2-amino-5-(4-ethylphenoxy)-4-pyrimidinyl]amino]-1-cyclohexanone IUPAC Name: 4-[[2-amino-5-(4-ethylphenoxy)pyrimidin-4-yl]amino]cyclohexan-1-one Traditional Name: 4-[[2-amino-5-(4-ethylphenoxy)pyrimidin-4-yl]amino]cyclohexanone Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=CN=C(N=C2NC3CCC(=O)CC3)N

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=CN=C(N=C2NC3CCC(=O)CC3)N

InChI

InChI=1S/C18H22N4O2/c1-2-12-3-9-15(10-4-12)24-16-11-20-18(19)22-17(16)21-13-5-7-14(23)8-6-13/h3-4,9-11,13H,2,5-8H2,1H3,(H3,19,20,21,22)