2-(3-propylsulfanyl-1H-1,2,4-triazol-5-yl)aniline

Systemtic Name: 2-(3-propylsulfanyl-1H-1,2,4-triazol-5-yl)aniline Openeye Name: 2-(3-propylsulfanyl-1H-1,2,4-triazol-5-yl)aniline CAS Name: 2-[3-(propylthio)-1H-1,2,4-triazol-5-yl]aniline IUPAC Name: 2-(3-propylsulfanyl-1H-1,2,4-triazol-5-yl)aniline Traditional Name: [2-[3-(propylthio)-1H-1,2,4-triazol-5-yl]phenyl]amine Formula: C11H14N4S MolecularWeight: 234.32066

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=N1)C2=CC=CC=C2N

Isomeric SMILES

CCCSC1=NNC(=N1)C2=CC=CC=C2N

InChI

InChI=1S/C11H14N4S/c1-2-7-16-11-13-10(14-15-11)8-5-3-4-6-9(8)12/h3-6H,2,7,12H2,1H3,(H,13,14,15)