N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-oxidanylidene-propyl]-4-(2,5-dihydropyrrol-1-ylcarbonyl)-3-methyl-benzamide

Systemtic Name: N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-oxidanylidene-propyl]-4-(2,5-dihydropyrrol-1-ylcarbonyl)-3-methyl-benzamide Openeye Name: N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-oxo-propyl]-4-(2,5-dihydropyrrole-1-carbonyl)-3-methyl-benzamide CAS Name: N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-oxopropyl]-4-[2,5-dihydropyrrol-1-yl(oxo)methyl]-3-methylbenzamide IUPAC Name: N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-oxopropyl]-4-(2,5-dihydropyrrole-1-carbonyl)-3-methylbenzamide Traditional Name: N-[3-(2-cyanoethylamino)-1-(3-cyanophenyl)-3-keto-propyl]-3-methyl-4-(3-pyrroline-1-carbonyl)benzamide Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(CC(=O)NCCC#N)C2=CC=CC(=C2)C#N)C(=O)N3CC=CC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(CC(=O)NCCC#N)C2=CC=CC(=C2)C#N)C(=O)N3CC=CC3

InChI

InChI=1S/C26H25N5O3/c1-18-14-21(8-9-22(18)26(34)31-12-2-3-13-31)25(33)30-23(16-24(32)29-11-5-10-27)20-7-4-6-19(15-20)17-28/h2-4,6-9,14-15,23H,5,11-13,16H2,1H3,(H,29,32)(H,30,33)