propan-2-yl 2,4-dimethyl-5-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-[[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C25H31N5O5 MolecularWeight: 481.54414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C(=C(N3)C)C(=O)OC(C)C)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C(=C(N3)C)C(=O)OC(C)C)C

InChI

InChI=1S/C25H31N5O5/c1-6-7-10-13-30-24(33)18-12-9-8-11-17(18)21(29-30)23(32)28-27-22(31)20-15(4)19(16(5)26-20)25(34)35-14(2)3/h8-9,11-12,14,26H,6-7,10,13H2,1-5H3,(H,27,31)(H,28,32)