N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-keto-phthalazine-1-carboxamide Formula: C29H30N6O2 MolecularWeight: 494.5875

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H30N6O2/c1-3-33(4-2)18-19-34-25-17-11-10-16-24(25)30-29(34)31-27(36)26-22-14-8-9-15-23(22)28(37)35(32-26)20-21-12-6-5-7-13-21/h5-17H,3-4,18-20H2,1-2H3,(H,30,31,36)