N-(2-chlorophenyl)-2-[4-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-[[1-oxo-4-(2-thienyl)phthalazin-2-yl]methyl]piperazin-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[(1-oxo-4-thiophen-2-yl-2-phthalazinyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-[(1-oxo-4-thiophen-2-ylphthalazin-2-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-[[1-keto-4-(2-thienyl)phthalazin-2-yl]methyl]piperazino]acetamide Formula: C25H24ClN5O2S MolecularWeight: 494.00836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2Cl)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2Cl)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5

InChI

InChI=1S/C25H24ClN5O2S/c26-20-8-3-4-9-21(20)27-23(32)16-29-11-13-30(14-12-29)17-31-25(33)19-7-2-1-6-18(19)24(28-31)22-10-5-15-34-22/h1-10,15H,11-14,16-17H2,(H,27,32)