5-[[4-[(E)-but-2-enyl]-3,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[4-[(E)-but-2-enyl]-3,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[4-[(E)-but-2-enyl]-3,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[4-[(E)-but-2-enyl]-3,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[4-[(E)-but-2-enyl]-3,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[4-[(E)-but-2-enyl]-3,5-dimethoxy-benzyl]pyrimidin-4-yl]amine Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1=C(C=C(C=C1OC)CC2=CN=C(N=C2N)N)OC

Isomeric SMILES

C/C=C/CC1=C(C=C(C=C1OC)CC2=CN=C(N=C2N)N)OC

InChI

InChI=1S/C17H22N4O2/c1-4-5-6-13-14(22-2)8-11(9-15(13)23-3)7-12-10-20-17(19)21-16(12)18/h4-5,8-10H,6-7H2,1-3H3,(H4,18,19,20,21)/b5-4+