N-[3-[3-cyclopropyl-5-(3-oxidanylidenebutylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-cyclopropyl-5-(3-oxidanylidenebutylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-cyclopropyl-5-(3-oxobutylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-cyclopropyl-5-(3-oxobutylthio)-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-cyclopropyl-5-(3-oxobutylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-cyclopropyl-5-(3-ketobutylthio)-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

Isomeric SMILES

CC(=O)CCSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

InChI

InChI=1S/C17H20N4O2S/c1-11(22)8-9-24-17-20-19-16(13-6-7-13)21(17)15-5-3-4-14(10-15)18-12(2)23/h3-5,10,13H,6-9H2,1-2H3,(H,18,23)