3-[4-(oxolan-2-ylmethyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-(oxolan-2-ylmethyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-(phenanthridin-6-ylmethylsulfanyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-(2-oxolanylmethyl)-5-(6-phenanthridinylmethylthio)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-(oxolan-2-ylmethyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-(phenanthridin-6-ylmethylthio)-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]propionamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=C2SCC3=NC4=CC=CC=C4C5=CC=CC=C53)CCC(=O)N

Isomeric SMILES

C1CC(OC1)CN2C(=NN=C2SCC3=NC4=CC=CC=C4C5=CC=CC=C53)CCC(=O)N

InChI

InChI=1S/C24H25N5O2S/c25-22(30)11-12-23-27-28-24(29(23)14-16-6-5-13-31-16)32-15-21-19-9-2-1-7-17(19)18-8-3-4-10-20(18)26-21/h1-4,7-10,16H,5-6,11-15H2,(H2,25,30)