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

Systemtic Name: 2-[[(4-chloranyl-3-nitro-phenyl)carbonyl-methyl-amino]methyl]-N-methyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-chloro-3-nitro-benzoyl)-methyl-amino]methyl]-N-methyl-thiazole-4-carboxamide CAS Name: 2-[[[(4-chloro-3-nitrophenyl)-oxomethyl]-methylamino]methyl]-N-methyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-chloro-3-nitrobenzoyl)-methylamino]methyl]-N-methyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-chloro-3-nitro-benzoyl)-methyl-amino]methyl]-N-methyl-thiazole-4-carboxamide Formula: C14H13ClN4O4S MolecularWeight: 368.79542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN4O4S/c1-16-13(20)10-7-24-12(17-10)6-18(2)14(21)8-3-4-9(15)11(5-8)19(22)23/h3-5,7H,6H2,1-2H3,(H,16,20)