5-(2-oxidanylbutyl)-1-phenyl-1,3,5-triazinane-2-thione

Systemtic Name: 5-(2-oxidanylbutyl)-1-phenyl-1,3,5-triazinane-2-thione Openeye Name: 5-(2-hydroxybutyl)-1-phenyl-1,3,5-triazinane-2-thione CAS Name: 5-(2-hydroxybutyl)-1-phenyl-1,3,5-triazinane-2-thione IUPAC Name: 5-(2-hydroxybutyl)-1-phenyl-1,3,5-triazinane-2-thione Traditional Name: 5-(2-hydroxybutyl)-1-phenyl-1,3,5-triazinane-2-thione Formula: C13H19N3OS MolecularWeight: 265.37446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CNC(=S)N(C1)C2=CC=CC=C2)O

Isomeric SMILES

CCC(CN1CNC(=S)N(C1)C2=CC=CC=C2)O

InChI

InChI=1S/C13H19N3OS/c1-2-12(17)8-15-9-14-13(18)16(10-15)11-6-4-3-5-7-11/h3-7,12,17H,2,8-10H2,1H3,(H,14,18)