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

Systemtic Name: N-[3-[3-cyclopropyl-5-(2-oxidanylidenepropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-(3-acetonylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)phenyl]acetamide CAS Name: N-[3-[3-cyclopropyl-5-(2-oxopropylthio)-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-cyclopropyl-5-(2-oxopropylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-(acetonylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

Isomeric SMILES

CC(=O)CSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

InChI

InChI=1S/C16H18N4O2S/c1-10(21)9-23-16-19-18-15(12-6-7-12)20(16)14-5-3-4-13(8-14)17-11(2)22/h3-5,8,12H,6-7,9H2,1-2H3,(H,17,22)