N-[2-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]pyrrolidine-1-carboxamide

Systemtic Name: N-[2-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]pyrrolidine-1-carboxamide Openeye Name: N-[2-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]pyrrolidine-1-carboxamide CAS Name: N-[2-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]ethyl]-1-pyrrolidinecarboxamide IUPAC Name: N-[2-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]pyrrolidine-1-carboxamide Traditional Name: N-[2-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]pyrrolidine-1-carboxamide Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)CCNC(=O)N3CCCC3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)CCNC(=O)N3CCCC3

InChI

InChI=1S/C17H23N5OS/c1-21-15(9-10-18-16(23)22-11-5-6-12-22)19-20-17(21)24-13-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-13H2,1H3,(H,18,23)