5-methyl-3-[(1S)-1-phenylethyl]sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-methyl-3-[(1S)-1-phenylethyl]sulfanyl-1H-1,2,4-triazole Openeye Name: 5-methyl-3-[(1S)-1-phenylethyl]sulfanyl-1H-1,2,4-triazole CAS Name: 5-methyl-3-[[(1S)-1-phenylethyl]thio]-1H-1,2,4-triazole IUPAC Name: 5-methyl-3-[(1S)-1-phenylethyl]sulfanyl-1H-1,2,4-triazole Traditional Name: 5-methyl-3-[[(1S)-1-phenylethyl]thio]-1H-1,2,4-triazole Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SC(C)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NN1)S[C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C11H13N3S/c1-8(10-6-4-3-5-7-10)15-11-12-9(2)13-14-11/h3-8H,1-2H3,(H,12,13,14)/t8-/m0/s1