3-[(4-propoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-propoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-propoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-propoxyphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-propoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-propoxybenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CSC2=NN=CN2N

Isomeric SMILES

CCCOC1=CC=C(C=C1)CSC2=NN=CN2N

InChI

InChI=1S/C12H16N4OS/c1-2-7-17-11-5-3-10(4-6-11)8-18-12-15-14-9-16(12)13/h3-6,9H,2,7-8,13H2,1H3