N-[[4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[[4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[[4-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl]methyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[4-[[(2-amino-2-oxoethyl)amino]-oxomethyl]phenyl]methyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[[4-[(2-amino-2-oxoethyl)carbamoyl]phenyl]methyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-[(2-amino-2-keto-ethyl)carbamoyl]benzyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)C(=O)NCC(=O)N

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)C(=O)NCC(=O)N

InChI

InChI=1S/C20H19N5O4/c1-25-20(29)15-5-3-2-4-14(15)17(24-25)19(28)22-10-12-6-8-13(9-7-12)18(27)23-11-16(21)26/h2-9H,10-11H2,1H3,(H2,21,26)(H,22,28)(H,23,27)