4-[4-ethyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline

Systemtic Name: 4-[4-ethyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Openeye Name: 4-(4-ethyl-5-isobutylsulfanyl-1,2,4-triazol-3-yl)-2-phenyl-quinoline CAS Name: 4-[4-ethyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]-2-phenylquinoline IUPAC Name: 4-[4-ethyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]-2-phenylquinoline Traditional Name: 4-[4-ethyl-5-(isobutylthio)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Formula: C23H24N4S MolecularWeight: 388.52846

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(C)C)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(C)C)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4S/c1-4-27-22(25-26-23(27)28-15-16(2)3)19-14-21(17-10-6-5-7-11-17)24-20-13-9-8-12-18(19)20/h5-14,16H,4,15H2,1-3H3