N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C25H20ClN5O3 MolecularWeight: 473.911

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5)Cl

InChI

InChI=1S/C25H20ClN5O3/c26-20-14-16(10-11-21(20)30-13-12-27-22(32)15-30)28-24(33)23-18-8-4-5-9-19(18)25(34)31(29-23)17-6-2-1-3-7-17/h1-11,14H,12-13,15H2,(H,27,32)(H,28,33)