[3-(butylcarbamoyl)-4-chloranyl-phenyl]sulfonyl-(4-methylsulfonylphenyl)azanide

Systemtic Name: [3-(butylcarbamoyl)-4-chloranyl-phenyl]sulfonyl-(4-methylsulfonylphenyl)azanide Openeye Name: [3-(butylcarbamoyl)-4-chloro-phenyl]sulfonyl-(4-methylsulfonylphenyl)azanide CAS Name: [3-[butylamino(oxo)methyl]-4-chlorophenyl]sulfonyl-(4-methylsulfonylphenyl)azanide IUPAC Name: [3-(butylcarbamoyl)-4-chlorophenyl]sulfonyl-(4-methylsulfonylphenyl)azanide Traditional Name: [3-(butylcarbamoyl)-4-chloro-phenyl]sulfonyl-(4-mesylphenyl)azanide Formula: C18H20ClN2O5S2- MolecularWeight: 443.9448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)[N-]C2=CC=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)[N-]C2=CC=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H20ClN2O5S2/c1-3-4-11-20-18(22)16-12-15(9-10-17(16)19)28(25,26)21-13-5-7-14(8-6-13)27(2,23)24/h5-10,12H,3-4,11H2,1-2H3,(H,20,22)/q-1