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

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(4-sulfamoylphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[(4-sulfamoylphenyl)methyl]thiazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[(4-sulfamoylphenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[(4-sulfamoylphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-(4-sulfamoylbenzyl)thiazole-4-carboxamide Formula: C15H20N4O3S3 MolecularWeight: 400.5393

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CS1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)N

Isomeric SMILES

CSCCC(C1=NC(=CS1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)N

InChI

InChI=1S/C15H20N4O3S3/c1-23-7-6-12(16)15-19-13(9-24-15)14(20)18-8-10-2-4-11(5-3-10)25(17,21)22/h2-5,9,12H,6-8,16H2,1H3,(H,18,20)(H2,17,21,22)