N-[2-chloranyl-5-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phthalazin-1-yl]phenyl]ethanamide

Systemtic Name: N-[2-chloranyl-5-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phthalazin-1-yl]phenyl]ethanamide Openeye Name: N-[2-chloro-5-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phthalazin-1-yl]phenyl]acetamide CAS Name: N-[2-chloro-5-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]-1-phthalazinyl]phenyl]acetamide IUPAC Name: N-[2-chloro-5-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phthalazin-1-yl]phenyl]acetamide Traditional Name: N-[2-chloro-5-[4-(4-o-toluoylpiperazino)phthalazin-1-yl]phenyl]acetamide Formula: C28H26ClN5O2 MolecularWeight: 499.99134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C5=CC(=C(C=C5)Cl)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C5=CC(=C(C=C5)Cl)NC(=O)C

InChI

InChI=1S/C28H26ClN5O2/c1-18-7-3-4-8-21(18)28(36)34-15-13-33(14-16-34)27-23-10-6-5-9-22(23)26(31-32-27)20-11-12-24(29)25(17-20)30-19(2)35/h3-12,17H,13-16H2,1-2H3,(H,30,35)