6-nitro-2-phenethylsulfanyl-1,3-benzothiazole

Systemtic Name: 6-nitro-2-phenethylsulfanyl-1,3-benzothiazole Openeye Name: 6-nitro-2-phenethylsulfanyl-1,3-benzothiazole CAS Name: 6-nitro-2-(phenethylthio)-1,3-benzothiazole IUPAC Name: 6-nitro-2-phenethylsulfanyl-1,3-benzothiazole Traditional Name: 6-nitro-2-(phenethylthio)-1,3-benzothiazole Formula: C15H12N2O2S2 MolecularWeight: 316.39798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O2S2/c18-17(19)12-6-7-13-14(10-12)21-15(16-13)20-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2