6-[(4-fluorophenyl)methyl]-4-(3-nitrophenyl)-1,3-benzothiazol-2-amine

Systemtic Name: 6-[(4-fluorophenyl)methyl]-4-(3-nitrophenyl)-1,3-benzothiazol-2-amine Openeye Name: 6-[(4-fluorophenyl)methyl]-4-(3-nitrophenyl)-1,3-benzothiazol-2-amine CAS Name: 6-[(4-fluorophenyl)methyl]-4-(3-nitrophenyl)-1,3-benzothiazol-2-amine IUPAC Name: 6-[(4-fluorophenyl)methyl]-4-(3-nitrophenyl)-1,3-benzothiazol-2-amine Traditional Name: [6-(4-fluorobenzyl)-4-(3-nitrophenyl)-1,3-benzothiazol-2-yl]amine Formula: C20H14FN3O2S MolecularWeight: 379.407463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC3=C2N=C(S3)N)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC3=C2N=C(S3)N)CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H14FN3O2S/c21-15-6-4-12(5-7-15)8-13-9-17(19-18(10-13)27-20(22)23-19)14-2-1-3-16(11-14)24(25)26/h1-7,9-11H,8H2,(H2,22,23)