1-[(2-chlorophenyl)methylsulfonyl]-2-(4,6-dimethoxypyrimidin-2-yl)-1-phenylmethoxy-guanidine

Systemtic Name: 1-[(2-chlorophenyl)methylsulfonyl]-2-(4,6-dimethoxypyrimidin-2-yl)-1-phenylmethoxy-guanidine Openeye Name: 1-benzyloxy-1-[(2-chlorophenyl)methylsulfonyl]-2-(4,6-dimethoxypyrimidin-2-yl)guanidine CAS Name: 1-[(2-chlorophenyl)methylsulfonyl]-2-(4,6-dimethoxy-2-pyrimidinyl)-1-phenylmethoxyguanidine IUPAC Name: 1-[(2-chlorophenyl)methylsulfonyl]-2-(4,6-dimethoxypyrimidin-2-yl)-1-phenylmethoxyguanidine Traditional Name: 1-benzoxy-1-(2-chlorobenzyl)sulfonyl-2-(4,6-dimethoxypyrimidin-2-yl)guanidine Formula: C21H22ClN5O5S MolecularWeight: 491.94788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)N=C(N)N(OCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3Cl)OC

Isomeric SMILES

COC1=CC(=NC(=N1)/N=C(/N)\N(OCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C21H22ClN5O5S/c1-30-18-12-19(31-2)25-21(24-18)26-20(23)27(32-13-15-8-4-3-5-9-15)33(28,29)14-16-10-6-7-11-17(16)22/h3-12H,13-14H2,1-2H3,(H2,23,24,25,26)