[4-[2-(3-chloranylphenoxy)propanoylamino]phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide

Systemtic Name: [4-[2-(3-chloranylphenoxy)propanoylamino]phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide Openeye Name: [4-[2-(3-chlorophenoxy)propanoylamino]phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide CAS Name: [4-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]phenyl]sulfonyl-(4-methyl-2-pyrimidinyl)azanide IUPAC Name: [4-[2-(3-chlorophenoxy)propanoylamino]phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide Traditional Name: [4-[2-(3-chlorophenoxy)propanoylamino]phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide Formula: C20H18ClN4O4S- MolecularWeight: 445.89932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H19ClN4O4S/c1-13-10-11-22-20(23-13)25-30(27,28)18-8-6-16(7-9-18)24-19(26)14(2)29-17-5-3-4-15(21)12-17/h3-12,14H,1-2H3,(H2,22,23,24,25,26)/p-1