2-(4-bromophenyl)sulfonyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine

Systemtic Name: 2-(4-bromophenyl)sulfonyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine Openeye Name: 2-(4-bromophenyl)sulfonyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine CAS Name: 2-(4-bromophenyl)sulfonyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethyl-2-pyrimidinyl)guanidine IUPAC Name: 2-(4-bromophenyl)sulfonyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine Traditional Name: 2-brosyl-1-(2,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine Formula: C21H22BrN5O4S MolecularWeight: 520.39948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NS(=O)(=O)C2=CC=C(C=C2)Br)NC3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/C(=N\S(=O)(=O)C2=CC=C(C=C2)Br)/NC3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H22BrN5O4S/c1-13-11-14(2)24-20(23-13)26-21(25-18-12-16(30-3)7-10-19(18)31-4)27-32(28,29)17-8-5-15(22)6-9-17/h5-12H,1-4H3,(H2,23,24,25,26,27)