1-(5-nitro-1,2-benzothiazol-3-yl)urea

Systemtic Name: 1-(5-nitro-1,2-benzothiazol-3-yl)urea Openeye Name: (5-nitro-1,2-benzothiazol-3-yl)urea CAS Name: (5-nitro-1,2-benzothiazol-3-yl)urea IUPAC Name: (5-nitro-1,2-benzothiazol-3-yl)urea Traditional Name: (5-nitro-1,2-benzothiazol-3-yl)urea Formula: C8H6N4O3S MolecularWeight: 238.22324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=NS2)NC(=O)N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=NS2)NC(=O)N

InChI

InChI=1S/C8H6N4O3S/c9-8(13)10-7-5-3-4(12(14)15)1-2-6(5)16-11-7/h1-3H,(H3,9,10,11,13)