1-(4,6-dimethoxypyrimidin-2-yl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-2-[2-(4-phenoxyphenyl)ethyl]guanidine Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=NCCC2=CC=C(C=C2)OC3=CC=CC=C3)N)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=NCCC2=CC=C(C=C2)OC3=CC=CC=C3)N)OC

InChI

InChI=1S/C21H23N5O3/c1-27-18-14-19(28-2)25-21(24-18)26-20(22)23-13-12-15-8-10-17(11-9-15)29-16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3,(H3,22,23,24,25,26)