3-[[4-(3-chlorophenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[[4-(3-chlorophenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[[4-(3-chlorophenyl)-5-isopropylsulfanyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[4-(3-chlorophenyl)-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[[4-(3-chlorophenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Traditional Name: 3-[[4-(3-chlorophenyl)-5-(isopropylthio)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Formula: C19H17ClN4OS2 MolecularWeight: 416.94748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C2=CC(=CC=C2)Cl)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CC(C)SC1=NN=C(N1C2=CC(=CC=C2)Cl)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C19H17ClN4OS2/c1-12(2)26-18-22-21-17(24(18)14-7-5-6-13(20)10-14)11-23-15-8-3-4-9-16(15)27-19(23)25/h3-10,12H,11H2,1-2H3