5-[(4-butan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-butan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-sec-butylphenoxy)methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-butan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-butan-2-ylphenoxy)methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(4-sec-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC2=NN=C(S2)N

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC2=NN=C(S2)N

InChI

InChI=1S/C13H17N3OS/c1-3-9(2)10-4-6-11(7-5-10)17-8-12-15-16-13(14)18-12/h4-7,9H,3,8H2,1-2H3,(H2,14,16)