4-ethoxy-N-[[5-(2-morpholin-4-ylethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline

Systemtic Name: 4-ethoxy-N-[[5-(2-morpholin-4-ylethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline Openeye Name: 4-ethoxy-N-[[5-(2-morpholinoethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline CAS Name: 4-ethoxy-N-[[5-[2-(4-morpholinyl)ethylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: 4-ethoxy-N-[[5-(2-morpholin-4-ylethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline Traditional Name: [5-(2-morpholinoethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl-p-phenetyl-amine Formula: C23H29N5O2S MolecularWeight: 439.57366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCCN4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCCN4CCOCC4

InChI

InChI=1S/C23H29N5O2S/c1-2-30-21-10-8-19(9-11-21)24-18-22-25-26-23(28(22)20-6-4-3-5-7-20)31-17-14-27-12-15-29-16-13-27/h3-11,24H,2,12-18H2,1H3