2-azanyl-5-[(3-nitrophenyl)methyl]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[(3-nitrophenyl)methyl]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[(3-nitrophenyl)methyl]thiazol-4-one CAS Name: 2-amino-5-[(3-nitrophenyl)methyl]-4-thiazolone IUPAC Name: 2-amino-5-[(3-nitrophenyl)methyl]-1,3-thiazol-4-one Traditional Name: 2-amino-5-(3-nitrobenzyl)-2-thiazolin-4-one Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CC2C(=O)N=C(S2)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CC2C(=O)N=C(S2)N

InChI

InChI=1S/C10H9N3O3S/c11-10-12-9(14)8(17-10)5-6-2-1-3-7(4-6)13(15)16/h1-4,8H,5H2,(H2,11,12,14)