3-[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[3-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

InChI

InChI=1S/C21H19N5O4/c22-19(28)18-15-6-1-2-7-16(15)21(30)26(25-18)11-17(27)23-14-5-3-4-12(10-14)20(29)24-13-8-9-13/h1-7,10,13H,8-9,11H2,(H2,22,28)(H,23,27)(H,24,29)