3-(4-chlorophenyl)-5-dodecan-2-ylsulfanyl-1-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-5-dodecan-2-ylsulfanyl-1-propan-2-yl-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-1-isopropyl-5-(1-methylundecylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-(dodecan-2-ylthio)-1-propan-2-yl-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-5-dodecan-2-ylsulfanyl-1-propan-2-yl-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-1-isopropyl-5-(1-methylundecylthio)-1,2,4-triazole Formula: C23H36ClN3S MolecularWeight: 422.07004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)SC1=NC(=NN1C(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCCCC(C)SC1=NC(=NN1C(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H36ClN3S/c1-5-6-7-8-9-10-11-12-13-19(4)28-23-25-22(26-27(23)18(2)3)20-14-16-21(24)17-15-20/h14-19H,5-13H2,1-4H3