N-(2-hydroxyethyl)-2-phthalazin-1-ylsulfanyl-ethanamide

Systemtic Name: N-(2-hydroxyethyl)-2-phthalazin-1-ylsulfanyl-ethanamide Openeye Name: N-(2-hydroxyethyl)-2-phthalazin-1-ylsulfanyl-acetamide CAS Name: N-(2-hydroxyethyl)-2-(1-phthalazinylthio)acetamide IUPAC Name: N-(2-hydroxyethyl)-2-phthalazin-1-ylsulfanylacetamide Traditional Name: N-(2-hydroxyethyl)-2-(phthalazin-1-ylthio)acetamide Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2SCC(=O)NCCO

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2SCC(=O)NCCO

InChI

InChI=1S/C12H13N3O2S/c16-6-5-13-11(17)8-18-12-10-4-2-1-3-9(10)7-14-15-12/h1-4,7,16H,5-6,8H2,(H,13,17)