6-chloranyl-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole

Systemtic Name: 6-chloranyl-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole Openeye Name: 6-chloro-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 6-chloro-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole IUPAC Name: 6-chloro-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole Traditional Name: 6-chloro-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C22H15ClN4OS2 MolecularWeight: 450.9637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=NC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=NC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C22H15ClN4OS2/c1-28-18-10-6-5-9-16(18)20-25-26-21(27(20)15-7-3-2-4-8-15)30-22-24-17-12-11-14(23)13-19(17)29-22/h2-13H,1H3