2-[[4-(4-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[[4-(4-chlorophenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[4-(4-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-(4-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[[4-(4-chlorophenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole Formula: C20H13ClN4S3 MolecularWeight: 440.99202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=CS5

InChI

InChI=1S/C20H13ClN4S3/c21-13-7-9-14(10-8-13)25-19(17-6-3-11-26-17)23-24-20(25)27-12-18-22-15-4-1-2-5-16(15)28-18/h1-11H,12H2