2-(4-methylphenyl)-5-nitro-1,3-benzothiazole

Systemtic Name: 2-(4-methylphenyl)-5-nitro-1,3-benzothiazole Openeye Name: 5-nitro-2-(p-tolyl)-1,3-benzothiazole CAS Name: 2-(4-methylphenyl)-5-nitro-1,3-benzothiazole IUPAC Name: 2-(4-methylphenyl)-5-nitro-1,3-benzothiazole Traditional Name: 5-nitro-2-(p-tolyl)-1,3-benzothiazole Formula: C14H10N2O2S MolecularWeight: 270.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O2S/c1-9-2-4-10(5-3-9)14-15-12-8-11(16(17)18)6-7-13(12)19-14/h2-8H,1H3