4-[[4-(2,3-diethyl-5-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonyl chloride

Systemtic Name: 4-[[4-(2,3-diethyl-5-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonyl chloride Openeye Name: 4-[[4-(2,3-diethyl-5-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonyl chloride CAS Name: 4-[[4-(2,3-diethyl-5-methyl-4-imidazolyl)-2-pyrimidinyl]amino]benzenesulfonyl chloride IUPAC Name: 4-[[4-(2,3-diethyl-5-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonyl chloride Traditional Name: 4-[[4-(2,3-diethyl-5-methyl-imidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonyl chloride Formula: C18H20ClN5O2S MolecularWeight: 405.9017

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1CC)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)Cl)C

Isomeric SMILES

CCC1=NC(=C(N1CC)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)Cl)C

InChI

InChI=1S/C18H20ClN5O2S/c1-4-16-21-12(3)17(24(16)5-2)15-10-11-20-18(23-15)22-13-6-8-14(9-7-13)27(19,25)26/h6-11H,4-5H2,1-3H3,(H,20,22,23)