8-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 8-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 8-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 8-[[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 8-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 8-[[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C25H20N4S MolecularWeight: 408.5181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H20N4S/c1-3-9-19(10-4-1)17-23-27-28-25(29(23)22-14-5-2-6-15-22)30-18-21-12-7-11-20-13-8-16-26-24(20)21/h1-16H,17-18H2