3-[(4-tert-butylphenoxy)methyl]-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-tert-butylphenoxy)methyl]-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-tert-butylphenoxy)methyl]-5-(2-morpholinoethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-tert-butylphenoxy)methyl]-5-[2-(4-morpholinyl)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-tert-butylphenoxy)methyl]-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-tert-butylphenoxy)methyl]-5-(2-morpholinoethylthio)-1,2,4-triazol-4-yl]amine Formula: C19H29N5O2S MolecularWeight: 391.53086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCCN3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCCN3CCOCC3

InChI

InChI=1S/C19H29N5O2S/c1-19(2,3)15-4-6-16(7-5-15)26-14-17-21-22-18(24(17)20)27-13-10-23-8-11-25-12-9-23/h4-7H,8-14,20H2,1-3H3