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

Systemtic Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-[[(cyclopropylamino)-oxomethyl]amino]phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C25H21N5O3 MolecularWeight: 439.46594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N5O3/c31-23(26-16-10-12-17(13-11-16)27-25(33)28-18-14-15-18)22-20-8-4-5-9-21(20)24(32)30(29-22)19-6-2-1-3-7-19/h1-13,18H,14-15H2,(H,26,31)(H2,27,28,33)