N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C21H22ClN5O2/c1-25-9-11-27(12-10-25)18-8-7-14(22)13-17(18)23-20(28)19-15-5-3-4-6-16(15)21(29)26(2)24-19/h3-8,13H,9-12H2,1-2H3,(H,23,28)