4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CN2C(=NNC2=S)CC3=CC=CC=C3

Isomeric SMILES

CC1(OCCO1)CN2C(=NNC2=S)CC3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2S/c1-14(18-7-8-19-14)10-17-12(15-16-13(17)20)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,16,20)