4-[4-[(2S)-butan-2-yl]phenyl]-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[4-[(2S)-butan-2-yl]phenyl]-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(methoxymethyl)-4-[4-[(1S)-1-methylpropyl]phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[4-[(2S)-butan-2-yl]phenyl]-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[4-[(2S)-butan-2-yl]phenyl]-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(methoxymethyl)-4-[4-[(1S)-1-methylpropyl]phenyl]-1H-1,2,4-triazole-5-thione Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=NNC2=S)COC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)N2C(=NNC2=S)COC

InChI

InChI=1S/C14H19N3OS/c1-4-10(2)11-5-7-12(8-6-11)17-13(9-18-3)15-16-14(17)19/h5-8,10H,4,9H2,1-3H3,(H,16,19)/t10-/m0/s1