2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[(2-methyl-3-nitrophenyl)methylthio]-1,3-benzothiazole IUPAC Name: 2-[(2-methyl-3-nitrophenyl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(2-methyl-3-nitro-benzyl)thio]-1,3-benzothiazole Formula: C15H12N2O2S2 MolecularWeight: 316.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H12N2O2S2/c1-10-11(5-4-7-13(10)17(18)19)9-20-15-16-12-6-2-3-8-14(12)21-15/h2-8H,9H2,1H3