3-[(2-butylsulfanylethanoylamino)carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 3-[(2-butylsulfanylethanoylamino)carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 3-[[(2-butylsulfanylacetyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 3-[[[2-(butylthio)-1-oxoethyl]hydrazo]-oxomethyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 3-[[(2-butylsulfanylacetyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 3-[[[2-(butylthio)acetyl]amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCSCC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H25N3O5S2/c1-3-4-12-29-14-19(24)21-22-20(25)15-6-5-7-18(13-15)30(26,27)23-16-8-10-17(28-2)11-9-16/h5-11,13,23H,3-4,12,14H2,1-2H3,(H,21,24)(H,22,25)