3-(5-methoxy-3,4-dimethyl-oxolan-2-yl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-methoxy-3,4-dimethyl-oxolan-2-yl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-(5-methoxy-3,4-dimethyl-tetrahydrofuran-2-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-methoxy-3,4-dimethyl-2-oxolanyl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-(5-methoxy-3,4-dimethyloxolan-2-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-(5-methoxy-3,4-dimethyl-tetrahydrofuran-2-yl)-1H-1,2,4-triazole-5-thione Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC1C2=NNC(=S)N2CC3=CC=CC=C3)OC)C

Isomeric SMILES

CC1C(C(OC1C2=NNC(=S)N2CC3=CC=CC=C3)OC)C

InChI

InChI=1S/C16H21N3O2S/c1-10-11(2)15(20-3)21-13(10)14-17-18-16(22)19(14)9-12-7-5-4-6-8-12/h4-8,10-11,13,15H,9H2,1-3H3,(H,18,22)