5-(4-methoxy-2-propan-2-yl-5-prop-1-ynyl-phenoxy)pyrimidine-2,4-diamine

Systemtic Name: 5-(4-methoxy-2-propan-2-yl-5-prop-1-ynyl-phenoxy)pyrimidine-2,4-diamine Openeye Name: 5-(2-isopropyl-4-methoxy-5-prop-1-ynyl-phenoxy)pyrimidine-2,4-diamine CAS Name: 5-(4-methoxy-2-propan-2-yl-5-prop-1-ynylphenoxy)pyrimidine-2,4-diamine IUPAC Name: 5-(4-methoxy-2-propan-2-yl-5-prop-1-ynylphenoxy)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(2-isopropyl-4-methoxy-5-prop-1-ynyl-phenoxy)pyrimidin-4-yl]amine Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=C(C=C1OC)C(C)C)OC2=CN=C(N=C2N)N

Isomeric SMILES

CC#CC1=CC(=C(C=C1OC)C(C)C)OC2=CN=C(N=C2N)N

InChI

InChI=1S/C17H20N4O2/c1-5-6-11-7-14(12(10(2)3)8-13(11)22-4)23-15-9-20-17(19)21-16(15)18/h7-10H,1-4H3,(H4,18,19,20,21)