2,6-bis[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 2,6-bis[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 2,6-bis[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2,6-bis[[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2,6-bis[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 2,6-bis[[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C37H31N7O2S2 MolecularWeight: 669.81774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=CC=C4)CSC5=NN=C(N5C6=CC=CC=C6)C7=CC=C(C=C7)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=CC=C4)CSC5=NN=C(N5C6=CC=CC=C6)C7=CC=C(C=C7)OC

InChI

InChI=1S/C37H31N7O2S2/c1-45-32-20-16-26(17-21-32)34-39-41-36(43(34)30-12-5-3-6-13-30)47-24-28-10-9-11-29(38-28)25-48-37-42-40-35(27-18-22-33(46-2)23-19-27)44(37)31-14-7-4-8-15-31/h3-23H,24-25H2,1-2H3