N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-methyl-benzamide

Systemtic Name: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-methyl-benzamide Openeye Name: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-methyl-benzamide CAS Name: N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-[2-(1H-indol-3-yl)ethylimino]methyl]-4-methylbenzamide IUPAC Name: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-methylbenzamide Traditional Name: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]amidino]-4-methyl-benzamide Formula: C25H26N6O MolecularWeight: 426.51354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=NCCC2=CNC3=CC=CC=C32)NC4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=NCCC2=CNC3=CC=CC=C32)NC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C25H26N6O/c1-16-8-10-19(11-9-16)23(32)30-24(31-25-28-17(2)14-18(3)29-25)26-13-12-20-15-27-22-7-5-4-6-21(20)22/h4-11,14-15,27H,12-13H2,1-3H3,(H2,26,28,29,30,31,32)