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

Systemtic Name: 3-[4-cyclopropyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCOC3=CC=CC=C3)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCCOC3=CC=CC=C3)CCC(=O)N

InChI

InChI=1S/C16H20N4O2S/c17-14(21)8-9-15-18-19-16(20(15)12-6-7-12)23-11-10-22-13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H2,17,21)