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

Systemtic Name: 4-(2,5-dimethoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,5-dimethoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,5-dimethoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,5-dimethoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,5-dimethoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)C3CC3C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)[C@@H]3C[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O2S/c1-23-13-8-9-17(24-2)16(10-13)22-18(20-21-19(22)25)15-11-14(15)12-6-4-3-5-7-12/h3-10,14-15H,11H2,1-2H3,(H,21,25)/t14-,15+/m0/s1