4-(2,2-diethoxyethyl)-3-(diphenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2,2-diethoxyethyl)-3-(diphenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzhydryl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,2-diethoxyethyl)-3-(diphenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzhydryl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzhydryl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=NNC1=S)C(C2=CC=CC=C2)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC(CN1C(=NNC1=S)C(C2=CC=CC=C2)C3=CC=CC=C3)OCC

InChI

InChI=1S/C21H25N3O2S/c1-3-25-18(26-4-2)15-24-20(22-23-21(24)27)19(16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-14,18-19H,3-4,15H2,1-2H3,(H,23,27)