N-[(3-fluorophenyl)methyl]-4-nitro-1,3-benzothiazol-5-amine

Systemtic Name: N-[(3-fluorophenyl)methyl]-4-nitro-1,3-benzothiazol-5-amine Openeye Name: N-[(3-fluorophenyl)methyl]-4-nitro-1,3-benzothiazol-5-amine CAS Name: N-[(3-fluorophenyl)methyl]-4-nitro-1,3-benzothiazol-5-amine IUPAC Name: N-[(3-fluorophenyl)methyl]-4-nitro-1,3-benzothiazol-5-amine Traditional Name: (3-fluorobenzyl)-(4-nitro-1,3-benzothiazol-5-yl)amine Formula: C14H10FN3O2S MolecularWeight: 303.311503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)F)CNC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H10FN3O2S/c15-10-3-1-2-9(6-10)7-16-11-4-5-12-13(17-8-21-12)14(11)18(19)20/h1-6,8,16H,7H2