2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-phenyl-1-propanone IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpropan-1-one Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-phenyl-propan-1-one Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NNC(=N2)C3CC3

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NNC(=N2)C3CC3

InChI

InChI=1S/C14H15N3OS/c1-9(12(18)10-5-3-2-4-6-10)19-14-15-13(16-17-14)11-7-8-11/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)