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

Systemtic Name: 2-[[(4-methylphenyl)sulfonyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: N-propyl-2-[[propyl(p-tolylsulfonyl)amino]methyl]thiazole-4-carboxamide CAS Name: 2-[[(4-methylphenyl)sulfonyl-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-methylphenyl)sulfonyl-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: N-propyl-2-[[propyl(tosyl)amino]methyl]thiazole-4-carboxamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H25N3O3S2/c1-4-10-19-18(22)16-13-25-17(20-16)12-21(11-5-2)26(23,24)15-8-6-14(3)7-9-15/h6-9,13H,4-5,10-12H2,1-3H3,(H,19,22)