2-chloranyl-N-(2-methoxyphenyl)-5-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(2-methoxyphenyl)-5-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide Openeye Name: 2-chloro-N-(2-methoxyphenyl)-5-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide CAS Name: 2-chloro-N-(2-methoxyphenyl)-5-[[[3-(methylthio)-1-oxopropyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: 2-chloro-N-(2-methoxyphenyl)-5-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide Traditional Name: 2-chloro-N-(2-methoxyphenyl)-5-[[3-(methylthio)propanoylamino]carbamoyl]benzenesulfonamide Formula: C18H20ClN3O5S2 MolecularWeight: 457.9515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)CCSC)Cl

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)CCSC)Cl

InChI

InChI=1S/C18H20ClN3O5S2/c1-27-15-6-4-3-5-14(15)22-29(25,26)16-11-12(7-8-13(16)19)18(24)21-20-17(23)9-10-28-2/h3-8,11,22H,9-10H2,1-2H3,(H,20,23)(H,21,24)