3-[(2-chlorophenyl)methyl]-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-chlorophenyl)methyl]-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-chlorophenyl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chlorophenyl)methyl]-4-(2-oxolanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chlorophenyl)methyl]-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-chlorobenzyl)-4-(tetrahydrofurfuryl)-1H-1,2,4-triazole-5-thione Formula: C14H16ClN3OS MolecularWeight: 309.81434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NNC2=S)CC3=CC=CC=C3Cl

Isomeric SMILES

C1CC(OC1)CN2C(=NNC2=S)CC3=CC=CC=C3Cl

InChI

InChI=1S/C14H16ClN3OS/c15-12-6-2-1-4-10(12)8-13-16-17-14(20)18(13)9-11-5-3-7-19-11/h1-2,4,6,11H,3,5,7-9H2,(H,17,20)