2-(2,6-dimethyl-4-nitro-phenyl)sulfanyl-5-methyl-1,3-benzothiazole

Systemtic Name: 2-(2,6-dimethyl-4-nitro-phenyl)sulfanyl-5-methyl-1,3-benzothiazole Openeye Name: 2-(2,6-dimethyl-4-nitro-phenyl)sulfanyl-5-methyl-1,3-benzothiazole CAS Name: 2-[(2,6-dimethyl-4-nitrophenyl)thio]-5-methyl-1,3-benzothiazole IUPAC Name: 2-(2,6-dimethyl-4-nitrophenyl)sulfanyl-5-methyl-1,3-benzothiazole Traditional Name: 2-[(2,6-dimethyl-4-nitro-phenyl)thio]-5-methyl-1,3-benzothiazole Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)SC3=C(C=C(C=C3C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)SC3=C(C=C(C=C3C)[N+](=O)[O-])C

InChI

InChI=1S/C16H14N2O2S2/c1-9-4-5-14-13(6-9)17-16(21-14)22-15-10(2)7-12(18(19)20)8-11(15)3/h4-8H,1-3H3