4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-N-(1-phenylethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazino]-N-(1-phenylethyl)phthalazine-1-carboxamide Formula: C28H28ClN5O2 MolecularWeight: 502.00722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=C(C=CC(=C5)Cl)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=C(C=CC(=C5)Cl)OC

InChI

InChI=1S/C28H28ClN5O2/c1-19(20-8-4-3-5-9-20)30-28(35)26-22-10-6-7-11-23(22)27(32-31-26)34-16-14-33(15-17-34)24-18-21(29)12-13-25(24)36-2/h3-13,18-19H,14-17H2,1-2H3,(H,30,35)