4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(1R)-1-phenylethyl]sulfanyl-1,2,4-triazole

Systemtic Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(1R)-1-phenylethyl]sulfanyl-1,2,4-triazole Openeye Name: 4-(4-ethoxyphenyl)-3-[(1R)-1-phenylethyl]sulfanyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[[(1R)-1-phenylethyl]thio]-1,2,4-triazole IUPAC Name: 4-(4-ethoxyphenyl)-3-(4-methylphenyl)-5-[(1R)-1-phenylethyl]sulfanyl-1,2,4-triazole Traditional Name: 3-[[(1R)-1-phenylethyl]thio]-4-p-phenetyl-5-(p-tolyl)-1,2,4-triazole Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SC(C)C3=CC=CC=C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2S[C@H](C)C3=CC=CC=C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H25N3OS/c1-4-29-23-16-14-22(15-17-23)28-24(21-12-10-18(2)11-13-21)26-27-25(28)30-19(3)20-8-6-5-7-9-20/h5-17,19H,4H2,1-3H3/t19-/m1/s1