2-[2-[4-(2-methylphenyl)phenyl]-4-nitro-phenyl]-1,3-benzothiazole

Systemtic Name: 2-[2-[4-(2-methylphenyl)phenyl]-4-nitro-phenyl]-1,3-benzothiazole Openeye Name: 2-[4-nitro-2-[4-(o-tolyl)phenyl]phenyl]-1,3-benzothiazole CAS Name: 2-[2-[4-(2-methylphenyl)phenyl]-4-nitrophenyl]-1,3-benzothiazole IUPAC Name: 2-[2-[4-(2-methylphenyl)phenyl]-4-nitrophenyl]-1,3-benzothiazole Traditional Name: 2-[4-nitro-2-[4-(o-tolyl)phenyl]phenyl]-1,3-benzothiazole Formula: C26H18N2O2S MolecularWeight: 422.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)C3=C(C=CC(=C3)[N+](=O)[O-])C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)C3=C(C=CC(=C3)[N+](=O)[O-])C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H18N2O2S/c1-17-6-2-3-7-21(17)18-10-12-19(13-11-18)23-16-20(28(29)30)14-15-22(23)26-27-24-8-4-5-9-25(24)31-26/h2-16H,1H3