3-(2-cyclobutylethylsulfanyl)-5,6-bis(4-ethoxyphenyl)-1,2,4-triazine

Systemtic Name: 3-(2-cyclobutylethylsulfanyl)-5,6-bis(4-ethoxyphenyl)-1,2,4-triazine Openeye Name: 3-(2-cyclobutylethylsulfanyl)-5,6-bis(4-ethoxyphenyl)-1,2,4-triazine CAS Name: 3-(2-cyclobutylethylthio)-5,6-bis(4-ethoxyphenyl)-1,2,4-triazine IUPAC Name: 3-(2-cyclobutylethylsulfanyl)-5,6-bis(4-ethoxyphenyl)-1,2,4-triazine Traditional Name: 3-(2-cyclobutylethylthio)-5,6-bis(p-phenetyl)-1,2,4-triazine Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(N=NC(=N2)SCCC3CCC3)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(N=NC(=N2)SCCC3CCC3)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C25H29N3O2S/c1-3-29-21-12-8-19(9-13-21)23-24(20-10-14-22(15-11-20)30-4-2)27-28-25(26-23)31-17-16-18-6-5-7-18/h8-15,18H,3-7,16-17H2,1-2H3