3-(4-tert-butylphenyl)-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-tert-butylphenyl)-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(4-tert-butylphenyl)-5-(2-morpholinoethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(4-tert-butylphenyl)-5-[2-(4-morpholinyl)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-tert-butylphenyl)-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(4-tert-butylphenyl)-5-(2-morpholinoethylthio)-1,2,4-triazol-4-yl]amine Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCCN3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCCN3CCOCC3

InChI

InChI=1S/C18H27N5OS/c1-18(2,3)15-6-4-14(5-7-15)16-20-21-17(23(16)19)25-13-10-22-8-11-24-12-9-22/h4-7H,8-13,19H2,1-3H3