2-[[(4-methyl-3-nitro-phenyl)carbonyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-methyl-3-nitro-phenyl)carbonyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-methyl-3-nitro-benzoyl)-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(4-methyl-3-nitrophenyl)-oxomethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-methyl-3-nitrobenzoyl)-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-methyl-3-nitro-benzoyl)-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O4S/c1-4-8-20-18(24)15-12-28-17(21-15)11-22(9-5-2)19(25)14-7-6-13(3)16(10-14)23(26)27/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,20,24)