N'-(4-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine

Systemtic Name: N'-(4-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine Openeye Name: N'-(4-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine CAS Name: N'-(4-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine IUPAC Name: N'-(4-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine Traditional Name: 2-aminoethyl-(4-nitro-1,3-benzothiazol-5-yl)amine Formula: C9H10N4O2S MolecularWeight: 238.2663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1NCCN)[N+](=O)[O-])N=CS2

Isomeric SMILES

C1=CC2=C(C(=C1NCCN)[N+](=O)[O-])N=CS2

InChI

InChI=1S/C9H10N4O2S/c10-3-4-11-6-1-2-7-8(12-5-16-7)9(6)13(14)15/h1-2,5,11H,3-4,10H2