2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole

Systemtic Name: 2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole Openeye Name: 2-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole CAS Name: 2-[(2-chloro-6-nitrophenyl)methylthio]-6-ethoxy-1,3-benzothiazole IUPAC Name: 2-[(2-chloro-6-nitrophenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole Traditional Name: 2-[(2-chloro-6-nitro-benzyl)thio]-6-ethoxy-1,3-benzothiazole Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O3S2/c1-2-22-10-6-7-13-15(8-10)24-16(18-13)23-9-11-12(17)4-3-5-14(11)19(20)21/h3-8H,2,9H2,1H3