3-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(2-chlorophenyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(2-chlorobenzyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC=C3Cl)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC=C3Cl)CCC(=O)N

InChI

InChI=1S/C15H17ClN4OS/c16-12-4-2-1-3-10(12)9-22-15-19-18-14(8-7-13(17)21)20(15)11-5-6-11/h1-4,11H,5-9H2,(H2,17,21)