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2-[(2,5-dimethoxyphenyl)methylsulfanyl]-6-nitro-1,3-benzothiazole

2-[(2,5-dimethoxyphenyl)methylsulfanyl]-6-nitro-1,3-benzothiazole

Systemtic Name:2-[(2,5-dimethoxyphenyl)methylsulfanyl]-6-nitro-1,3-benzothiazole
Openeye Name:2-[(2,5-dimethoxyphenyl)methylsulfanyl]-6-nitro-1,3-benzothiazole
CAS Name:2-[(2,5-dimethoxyphenyl)methylthio]-6-nitro-1,3-benzothiazole
IUPAC Name:2-[(2,5-dimethoxyphenyl)methylsulfanyl]-6-nitro-1,3-benzothiazole
Traditional Name:2-[(2,5-dimethoxybenzyl)thio]-6-nitro-1,3-benzothiazole
Formula: C16H14N2O4S2
MolecularWeight: 362.42336
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

COC1=CC(=C(C=C1)OC)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C16H14N2O4S2/c1-21-12-4-6-14(22-2)10(7-12)9-23-16-17-13-5-3-11(18(19)20)8-15(13)24-16/h3-8H,9H2,1-2H3


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