4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-thiophen-2-ylethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-thiophen-2-ylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-[2-(2-thienyl)ethyl]phthalazine-1-carboxamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-(2-thiophen-2-ylethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-thiophen-2-ylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-[2-(2-thienyl)ethyl]phthalazine-1-carboxamide Formula: C25H24ClN5OS MolecularWeight: 478.00896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CS5

InChI

InChI=1S/C25H24ClN5OS/c26-18-5-3-6-19(17-18)30-12-14-31(15-13-30)24-22-9-2-1-8-21(22)23(28-29-24)25(32)27-11-10-20-7-4-16-33-20/h1-9,16-17H,10-15H2,(H,27,32)