4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NNC2=S)C3CC3C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C(=NNC2=S)[C@@H]3C[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C18H17N3OS/c1-22-16-10-6-5-9-15(16)21-17(19-20-18(21)23)14-11-13(14)12-7-3-2-4-8-12/h2-10,13-14H,11H2,1H3,(H,20,23)/t13-,14+/m0/s1