4-azanyl-N-[4,6-diethyl-5-(2-hydroxyphenyl)pyrimidin-2-yl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[4,6-diethyl-5-(2-hydroxyphenyl)pyrimidin-2-yl]benzenesulfonamide Openeye Name: 4-amino-N-[4,6-diethyl-5-(2-hydroxyphenyl)pyrimidin-2-yl]benzenesulfonamide CAS Name: 4-amino-N-[4,6-diethyl-5-(2-hydroxyphenyl)-2-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-amino-N-[4,6-diethyl-5-(2-hydroxyphenyl)pyrimidin-2-yl]benzenesulfonamide Traditional Name: 4-amino-N-[4,6-diethyl-5-(2-hydroxyphenyl)pyrimidin-2-yl]benzenesulfonamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)CC)C3=CC=CC=C3O

Isomeric SMILES

CCC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)CC)C3=CC=CC=C3O

InChI

InChI=1S/C20H22N4O3S/c1-3-16-19(15-7-5-6-8-18(15)25)17(4-2)23-20(22-16)24-28(26,27)14-11-9-13(21)10-12-14/h5-12,25H,3-4,21H2,1-2H3,(H,22,23,24)