5-butan-2-yl-3-propylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-butan-2-yl-3-propylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-propylsulfanyl-5-sec-butyl-1H-1,2,4-triazole CAS Name: 5-butan-2-yl-3-(propylthio)-1H-1,2,4-triazole IUPAC Name: 5-butan-2-yl-3-propylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(propylthio)-5-sec-butyl-1H-1,2,4-triazole Formula: C9H17N3S MolecularWeight: 199.31638

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=N1)C(C)CC

Isomeric SMILES

CCCSC1=NNC(=N1)C(C)CC

InChI

InChI=1S/C9H17N3S/c1-4-6-13-9-10-8(11-12-9)7(3)5-2/h7H,4-6H2,1-3H3,(H,10,11,12)