3-[(3-methylsulfanylpropanoylamino)carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[(3-methylsulfanylpropanoylamino)carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide CAS Name: 3-[[[3-(methylthio)-1-oxopropyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[(3-methylsulfanylpropanoylamino)carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[3-(methylthio)propanoylamino]carbamoyl]benzenesulfonamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2

Isomeric SMILES

CSCCC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4S2/c1-26-11-10-17(22)20-21-18(23)15-8-5-9-16(12-15)27(24,25)19-13-14-6-3-2-4-7-14/h2-9,12,19H,10-11,13H2,1H3,(H,20,22)(H,21,23)