2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3-benzothiazole

Systemtic Name: 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3-benzothiazole Openeye Name: 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3-benzothiazole CAS Name: 2-[(4-methylsulfonyl-2-nitrophenyl)thio]-1,3-benzothiazole IUPAC Name: 2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3-benzothiazole Traditional Name: 2-[(4-mesyl-2-nitro-phenyl)thio]-1,3-benzothiazole Formula: C14H10N2O4S3 MolecularWeight: 366.4352

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O4S3/c1-23(19,20)9-6-7-13(11(8-9)16(17)18)22-14-15-10-4-2-3-5-12(10)21-14/h2-8H,1H3