N'-[(E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)prop-2-enoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)prop-2-enoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-[(E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)prop-2-enoyl]-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[(E)-3-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-1-oxoprop-2-enyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[(E)-3-(2,5-dimethyl-1-phenylpyrrol-3-yl)prop-2-enoyl]-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-[(E)-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)acryloyl]-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)/C=C/C3=C(N(C(=C3)C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H27N5O3/c1-4-16-31-27(35)23-13-9-8-12-22(23)25(30-31)26(34)29-28-24(33)15-14-20-17-18(2)32(19(20)3)21-10-6-5-7-11-21/h5-15,17H,4,16H2,1-3H3,(H,28,33)(H,29,34)/b15-14+