3-methyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Systemtic Name: 3-methyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-methyl-6-thiophen-2-yl-4-isoxazolo[5,4-b]pyridinecarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxamide Formula: C19H14N4O5S MolecularWeight: 410.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=C(C=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

CC1=NOC2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=C(C=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C19H14N4O5S/c1-10-17-13(8-14(16-3-2-6-29-16)21-19(17)28-22-10)18(25)20-9-11-7-12(23(26)27)4-5-15(11)24/h2-8,24H,9H2,1H3,(H,20,25)