N-(furan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H17N3O2S/c25-19(22-13-16-9-6-12-26-16)14-27-21-18-11-5-4-10-17(18)20(23-24-21)15-7-2-1-3-8-15/h1-12H,13-14H2,(H,22,25)