4-oxidanylidene-N-[3-(phenylcarbamoylamino)phenyl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-(phenylcarbamoylamino)phenyl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[3-(phenylcarbamoylamino)phenyl]-3H-phthalazine-1-carboxamide CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[3-(phenylcarbamoylamino)phenyl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-(phenylcarbamoylamino)phenyl]-3H-phthalazine-1-carboxamide Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H17N5O3/c28-20-18-12-5-4-11-17(18)19(26-27-20)21(29)23-15-9-6-10-16(13-15)25-22(30)24-14-7-2-1-3-8-14/h1-13H,(H,23,29)(H,27,28)(H2,24,25,30)