N-[[4-carbamimidoyl-2-(ethylamino)phenyl]methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide

Systemtic Name: N-[[4-carbamimidoyl-2-(ethylamino)phenyl]methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide Openeye Name: N-[[4-carbamimidoyl-2-(ethylamino)phenyl]methyl]-2-ethoxy-2-(4-methyl-1-oxo-isoindolin-2-yl)acetamide CAS Name: N-[[4-carbamimidoyl-2-(ethylamino)phenyl]methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide IUPAC Name: N-[[4-carbamimidoyl-2-(ethylamino)phenyl]methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide Traditional Name: N-[4-amidino-2-(ethylamino)benzyl]-2-ethoxy-2-(1-keto-4-methyl-isoindolin-2-yl)acetamide Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)C(=N)N)CNC(=O)C(N2CC3=C(C2=O)C=CC=C3C)OCC

Isomeric SMILES

CCNC1=C(C=CC(=C1)C(=N)N)CNC(=O)C(N2CC3=C(C2=O)C=CC=C3C)OCC

InChI

InChI=1S/C23H29N5O3/c1-4-26-19-11-15(20(24)25)9-10-16(19)12-27-21(29)23(31-5-2)28-13-18-14(3)7-6-8-17(18)22(28)30/h6-11,23,26H,4-5,12-13H2,1-3H3,(H3,24,25)(H,27,29)