3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide

Systemtic Name: 3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide CAS Name: 3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-phenylpropanamide IUPAC Name: 3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: 3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-phenyl-propionamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C16H20N4OS/c1-2-20-15(12-8-9-12)18-19-16(20)22-11-10-14(21)17-13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3,(H,17,21)