5-phenyl-3-propan-2-ylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-phenyl-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-isopropylsulfanyl-5-phenyl-1H-1,2,4-triazole CAS Name: 5-phenyl-3-(propan-2-ylthio)-1H-1,2,4-triazole IUPAC Name: 5-phenyl-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(isopropylthio)-5-phenyl-1H-1,2,4-triazole Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)SC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C11H13N3S/c1-8(2)15-11-12-10(13-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13,14)