4-[4-(phenylmethyl)-5-(quinolin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[4-(phenylmethyl)-5-(quinolin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[4-benzyl-5-(2-quinolylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[4-(phenylmethyl)-5-(2-quinolinylmethylthio)-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[4-benzyl-5-(quinolin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[4-benzyl-5-(2-quinolylmethylthio)-1,2,4-triazol-3-yl]morpholine Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(N2CC3=CC=CC=C3)SCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1COCCN1C2=NN=C(N2CC3=CC=CC=C3)SCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H23N5OS/c1-2-6-18(7-3-1)16-28-22(27-12-14-29-15-13-27)25-26-23(28)30-17-20-11-10-19-8-4-5-9-21(19)24-20/h1-11H,12-17H2