5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pentan-2-one

Systemtic Name: 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pentan-2-one Openeye Name: 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pentan-2-one CAS Name: 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-2-pentanone IUPAC Name: 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pentan-2-one Traditional Name: 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]pentan-2-one Formula: C13H19N3OS MolecularWeight: 265.37446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCSC1=NN=C(N1C2CC2)C3CC3

Isomeric SMILES

CC(=O)CCCSC1=NN=C(N1C2CC2)C3CC3

InChI

InChI=1S/C13H19N3OS/c1-9(17)3-2-8-18-13-15-14-12(10-4-5-10)16(13)11-6-7-11/h10-11H,2-8H2,1H3