2-[(4-methylphenoxy)methyl]-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-methylphenoxy)methyl]-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-[(4-methylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H17N3O5S/c1-12-2-5-15(6-3-12)27-10-18-21-16(11-28-18)19(24)20-9-13-8-14(22(25)26)4-7-17(13)23/h2-8,11,23H,9-10H2,1H3,(H,20,24)