N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-cyclopropyl-N-p-anisyl-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c1-32-22-15-11-19(12-16-22)17-30(21-13-14-21)25(31)18-33-27-24-10-6-5-9-23(24)26(28-29-27)20-7-3-2-4-8-20/h2-12,15-16,21H,13-14,17-18H2,1H3