3-[3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(2-furyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-(2-furanyl)-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-(furan-2-yl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-(2-furyl)-5-[(4-methylbenzyl)thio]-1,2,4-triazol-4-yl]propionamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CO3

InChI

InChI=1S/C17H18N4O2S/c1-12-4-6-13(7-5-12)11-24-17-20-19-16(14-3-2-10-23-14)21(17)9-8-15(18)22/h2-7,10H,8-9,11H2,1H3,(H2,18,22)