4-(2,2-diethoxyethyl)-3-methylsulfanyl-5-(1-phenylethyl)-1,2,4-triazole

Systemtic Name: 4-(2,2-diethoxyethyl)-3-methylsulfanyl-5-(1-phenylethyl)-1,2,4-triazole Openeye Name: 4-(2,2-diethoxyethyl)-3-methylsulfanyl-5-(1-phenylethyl)-1,2,4-triazole CAS Name: 4-(2,2-diethoxyethyl)-3-(methylthio)-5-(1-phenylethyl)-1,2,4-triazole IUPAC Name: 4-(2,2-diethoxyethyl)-3-methylsulfanyl-5-(1-phenylethyl)-1,2,4-triazole Traditional Name: 4-(2,2-diethoxyethyl)-3-(methylthio)-5-(1-phenylethyl)-1,2,4-triazole Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=NN=C1SC)C(C)C2=CC=CC=C2)OCC

Isomeric SMILES

CCOC(CN1C(=NN=C1SC)C(C)C2=CC=CC=C2)OCC

InChI

InChI=1S/C17H25N3O2S/c1-5-21-15(22-6-2)12-20-16(18-19-17(20)23-4)13(3)14-10-8-7-9-11-14/h7-11,13,15H,5-6,12H2,1-4H3