N-[N'-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[N'-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[2-(5-chloro-1H-indol-3-yl)ethylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[N'-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(4,6-dimethylpyrimidin-2-yl)amidino]-3,4,5-trimethoxy-benzamide Formula: C27H29ClN6O4 MolecularWeight: 537.00996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C

InChI

InChI=1S/C27H29ClN6O4/c1-15-10-16(2)32-27(31-15)34-26(29-9-8-17-14-30-21-7-6-19(28)13-20(17)21)33-25(35)18-11-22(36-3)24(38-5)23(12-18)37-4/h6-7,10-14,30H,8-9H2,1-5H3,(H2,29,31,32,33,34,35)