N-[[4-(diethylamino)phenyl]methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[[4-(diethylamino)phenyl]methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[[4-(diethylamino)phenyl]methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[4-(diethylamino)phenyl]methylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[[4-(diethylamino)phenyl]methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[[4-(diethylamino)benzylidene]amino]-4-keto-phthalazine-1-carboxamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O2/c1-3-31(4-2)22-16-14-20(15-17-22)18-28-29-26(33)25-23-12-8-9-13-24(23)27(34)32(30-25)19-21-10-6-5-7-11-21/h5-18H,3-4,19H2,1-2H3,(H,29,33)