4-[4-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline

Systemtic Name: 4-[4-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Openeye Name: 4-[4-methyl-5-(1-naphthylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline CAS Name: 4-[4-methyl-5-(1-naphthalenylmethylthio)-1,2,4-triazol-3-yl]-2-phenylquinoline IUPAC Name: 4-[4-methyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenylquinoline Traditional Name: 4-[4-methyl-5-(1-naphthylmethylthio)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Formula: C29H22N4S MolecularWeight: 458.57678

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C29H22N4S/c1-33-28(31-32-29(33)34-19-22-14-9-13-20-10-5-6-15-23(20)22)25-18-27(21-11-3-2-4-12-21)30-26-17-8-7-16-24(25)26/h2-18H,19H2,1H3