2-[[5-(3-chloranyl-1-benzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-(3-chloranyl-1-benzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[[5-(3-chlorobenzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[5-(3-chloro-1-benzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[[5-(3-chlorobenzothiophen-2-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole Formula: C24H15ClN4S3 MolecularWeight: 491.0507

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4S3)C5=C(C6=CC=CC=C6S5)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4S3)C5=C(C6=CC=CC=C6S5)Cl

InChI

InChI=1S/C24H15ClN4S3/c25-21-16-10-4-6-12-18(16)32-22(21)23-27-28-24(29(23)15-8-2-1-3-9-15)30-14-20-26-17-11-5-7-13-19(17)31-20/h1-13H,14H2