2-(1-azanyl-3-methylsulfanyl-propyl)-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[2-(4-sulfamoylphenyl)ethyl]thiazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-(4-sulfamoylphenyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-(4-sulfamoylphenyl)ethyl]thiazole-4-carboxamide Formula: C16H22N4O3S3 MolecularWeight: 414.56588

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CS1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)N

Isomeric SMILES

CSCCC(C1=NC(=CS1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)N

InChI

InChI=1S/C16H22N4O3S3/c1-24-9-7-13(17)16-20-14(10-25-16)15(21)19-8-6-11-2-4-12(5-3-11)26(18,22)23/h2-5,10,13H,6-9,17H2,1H3,(H,19,21)(H2,18,22,23)