2-azanyl-5-[(3-nitro-4-oxidanyl-phenyl)methyl]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[(3-nitro-4-oxidanyl-phenyl)methyl]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[(4-hydroxy-3-nitro-phenyl)methyl]thiazol-4-one CAS Name: 2-amino-5-[(4-hydroxy-3-nitrophenyl)methyl]-4-thiazolone IUPAC Name: 2-amino-5-[(4-hydroxy-3-nitrophenyl)methyl]-1,3-thiazol-4-one Traditional Name: 2-amino-5-(4-hydroxy-3-nitro-benzyl)-2-thiazolin-4-one Formula: C10H9N3O4S MolecularWeight: 267.26116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2C(=O)N=C(S2)N)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1CC2C(=O)N=C(S2)N)[N+](=O)[O-])O

InChI

InChI=1S/C10H9N3O4S/c11-10-12-9(15)8(18-10)4-5-1-2-7(14)6(3-5)13(16)17/h1-3,8,14H,4H2,(H2,11,12,15)