5-[[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-[(1S)-1-cyclopropylbut-3-enoxy]-4,5-dimethoxy-benzyl]pyrimidin-4-yl]amine Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)OC(CC=C)C3CC3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)O[C@@H](CC=C)C3CC3)OC

InChI

InChI=1S/C20H26N4O3/c1-4-5-15(13-6-7-13)27-17-10-12(9-16(25-2)18(17)26-3)8-14-11-23-20(22)24-19(14)21/h4,9-11,13,15H,1,5-8H2,2-3H3,(H4,21,22,23,24)/t15-/m0/s1