3-(4-ethoxyphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(4-ethoxyphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(4-ethoxyphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(4-ethoxyphenyl)-N-[3-(4-ethyl-1-piperazinyl)propyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(4-ethoxyphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-(4-ethylpiperazino)propyl]-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C26H33N5O3 MolecularWeight: 463.57192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C26H33N5O3/c1-3-29-16-18-30(19-17-29)15-7-14-27-25(32)24-22-8-5-6-9-23(22)26(33)31(28-24)20-10-12-21(13-11-20)34-4-2/h5-6,8-13H,3-4,7,14-19H2,1-2H3,(H,27,32)