2-[[(4-bromophenyl)sulfonyl-butyl-amino]methyl]-N-butyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-bromophenyl)sulfonyl-butyl-amino]methyl]-N-butyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-bromophenyl)sulfonyl-butyl-amino]methyl]-N-butyl-thiazole-4-carboxamide CAS Name: 2-[[(4-bromophenyl)sulfonyl-butylamino]methyl]-N-butyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-bromophenyl)sulfonyl-butylamino]methyl]-N-butyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[brosyl(butyl)amino]methyl]-N-butyl-thiazole-4-carboxamide Formula: C19H26BrN3O3S2 MolecularWeight: 488.46204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CN(CCCC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H26BrN3O3S2/c1-3-5-11-21-19(24)17-14-27-18(22-17)13-23(12-6-4-2)28(25,26)16-9-7-15(20)8-10-16/h7-10,14H,3-6,11-13H2,1-2H3,(H,21,24)