2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethylphenyl)ethanone

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethylphenyl)ethanone Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethylphenyl)ethanone CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-(4-ethylphenyl)ethanone IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethylphenyl)ethanone Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-(4-ethylphenyl)ethanone Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)C3CC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)C3CC3

InChI

InChI=1S/C15H17N3OS/c1-2-10-3-5-11(6-4-10)13(19)9-20-15-16-14(17-18-15)12-7-8-12/h3-6,12H,2,7-9H2,1H3,(H,16,17,18)