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

Systemtic Name: 2-(5-methylfuran-2-yl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-(5-methyl-2-furyl)thiazole-4-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(5-methyl-2-furanyl)-4-thiazolecarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(5-methylfuran-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-(5-methyl-2-furyl)thiazole-4-carboxamide Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H13N3O5S/c1-9-2-5-14(24-9)16-18-12(8-25-16)15(21)17-7-10-6-11(19(22)23)3-4-13(10)20/h2-6,8,20H,7H2,1H3,(H,17,21)