4-[[7-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]carbonylcyclopropyl]-4-methyl-3-oxidanylidene-quinoxalin-2-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-[[7-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]carbonylcyclopropyl]-4-methyl-3-oxidanylidene-quinoxalin-2-yl]methyl]benzenecarboximidamide Openeye Name: 4-[[7-[1-[2-(hydroxymethyl)pyrrolidine-1-carbonyl]cyclopropyl]-4-methyl-3-oxo-quinoxalin-2-yl]methyl]benzamidine CAS Name: 4-[[7-[1-[[2-(hydroxymethyl)-1-pyrrolidinyl]-oxomethyl]cyclopropyl]-4-methyl-3-oxo-2-quinoxalinyl]methyl]benzenecarboximidamide IUPAC Name: 4-[[7-[1-[2-(hydroxymethyl)pyrrolidine-1-carbonyl]cyclopropyl]-4-methyl-3-oxoquinoxalin-2-yl]methyl]benzenecarboximidamide Traditional Name: 4-[[3-keto-4-methyl-7-[1-(2-methylolpyrrolidine-1-carbonyl)cyclopropyl]quinoxalin-2-yl]methyl]benzamidine Formula: C26H29N5O3 MolecularWeight: 459.54016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3(CC3)C(=O)N4CCCC4CO)N=C(C1=O)CC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3(CC3)C(=O)N4CCCC4CO)N=C(C1=O)CC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C26H29N5O3/c1-30-22-9-8-18(26(10-11-26)25(34)31-12-2-3-19(31)15-32)14-20(22)29-21(24(30)33)13-16-4-6-17(7-5-16)23(27)28/h4-9,14,19,32H,2-3,10-13,15H2,1H3,(H3,27,28)