2-azanyl-N-[2-(4-sulfamoylphenyl)ethylcarbamothioyl]butanediamide

Systemtic Name: 2-azanyl-N-[2-(4-sulfamoylphenyl)ethylcarbamothioyl]butanediamide Openeye Name: 2-amino-N-[2-(4-sulfamoylphenyl)ethylcarbamothioyl]butanediamide CAS Name: 2-amino-N-[[2-(4-sulfamoylphenyl)ethylamino]-sulfanylidenemethyl]butanediamide IUPAC Name: 2-amino-N-[2-(4-sulfamoylphenyl)ethylcarbamothioyl]butanediamide Traditional Name: 2-amino-N-[2-(4-sulfamoylphenyl)ethylthiocarbamoyl]succinamide Formula: C13H19N5O4S2 MolecularWeight: 373.45106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=S)NC(=O)C(CC(=O)N)N)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=S)NC(=O)C(CC(=O)N)N)S(=O)(=O)N

InChI

InChI=1S/C13H19N5O4S2/c14-10(7-11(15)19)12(20)18-13(23)17-6-5-8-1-3-9(4-2-8)24(16,21)22/h1-4,10H,5-7,14H2,(H2,15,19)(H2,16,21,22)(H2,17,18,20,23)