1-ethyl-3-(6-nitro-7-oxidanyl-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-ethyl-3-(6-nitro-7-oxidanyl-1,3-benzothiazol-2-yl)urea Openeye Name: 1-ethyl-3-(7-hydroxy-6-nitro-1,3-benzothiazol-2-yl)urea CAS Name: 1-ethyl-3-(7-hydroxy-6-nitro-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-ethyl-3-(7-hydroxy-6-nitro-1,3-benzothiazol-2-yl)urea Traditional Name: 1-ethyl-3-(7-hydroxy-6-nitro-1,3-benzothiazol-2-yl)urea Formula: C10H10N4O4S MolecularWeight: 282.2758

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C(=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C(=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C10H10N4O4S/c1-2-11-9(16)13-10-12-5-3-4-6(14(17)18)7(15)8(5)19-10/h3-4,15H,2H2,1H3,(H2,11,12,13,16)