N-[(1-ethyl-2-oxidanylidene-indol-3-ylidene)amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(1-ethyl-2-oxidanylidene-indol-3-ylidene)amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(1-ethyl-2-oxo-indolin-3-ylidene)amino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1-ethyl-2-oxo-3-indolylidene)amino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(1-ethyl-2-oxoindol-3-ylidene)amino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(1-ethyl-2-keto-indolin-3-ylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C26H21N5O3 MolecularWeight: 451.47664

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5)C1=O

Isomeric SMILES

CCN1C2=CC=CC=C2C(=NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5)C1=O

InChI

InChI=1S/C26H21N5O3/c1-2-30-21-15-9-8-14-20(21)23(26(30)34)27-28-24(32)22-18-12-6-7-13-19(18)25(33)31(29-22)16-17-10-4-3-5-11-17/h3-15H,2,16H2,1H3,(H,28,32)