N-(phenylmethyl)-2-phthalazin-1-ylsulfanyl-butanamide

Systemtic Name: N-(phenylmethyl)-2-phthalazin-1-ylsulfanyl-butanamide Openeye Name: N-benzyl-2-phthalazin-1-ylsulfanyl-butanamide CAS Name: N-(phenylmethyl)-2-(1-phthalazinylthio)butanamide IUPAC Name: N-benzyl-2-phthalazin-1-ylsulfanylbutanamide Traditional Name: N-benzyl-2-(phthalazin-1-ylthio)butyramide Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=CC3=CC=CC=C32

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=CC3=CC=CC=C32

InChI

InChI=1S/C19H19N3OS/c1-2-17(18(23)20-12-14-8-4-3-5-9-14)24-19-16-11-7-6-10-15(16)13-21-22-19/h3-11,13,17H,2,12H2,1H3,(H,20,23)