N-[[4-[(N'-cyanocarbamimidoyl)-methyl-amino]-1-phenyl-cyclohexyl]methyl]-2,4,5-trimethoxy-benzamide

Systemtic Name: N-[[4-[(N'-cyanocarbamimidoyl)-methyl-amino]-1-phenyl-cyclohexyl]methyl]-2,4,5-trimethoxy-benzamide Openeye Name: N-[[4-[(N'-cyanocarbamimidoyl)-methyl-amino]-1-phenyl-cyclohexyl]methyl]-2,4,5-trimethoxy-benzamide CAS Name: N-[[4-[[amino(cyanoimino)methyl]-methylamino]-1-phenylcyclohexyl]methyl]-2,4,5-trimethoxybenzamide IUPAC Name: N-[[4-[(N'-cyanocarbamimidoyl)-methylamino]-1-phenylcyclohexyl]methyl]-2,4,5-trimethoxybenzamide Traditional Name: N-[[4-[(N'-cyanoamidino)-methyl-amino]-1-phenyl-cyclohexyl]methyl]-2,4,5-trimethoxy-benzamide Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2OC)OC)OC)C3=CC=CC=C3)C(=NC#N)N

Isomeric SMILES

CN(C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2OC)OC)OC)C3=CC=CC=C3)C(=NC#N)N

InChI

InChI=1S/C26H33N5O4/c1-31(25(28)30-17-27)19-10-12-26(13-11-19,18-8-6-5-7-9-18)16-29-24(32)20-14-22(34-3)23(35-4)15-21(20)33-2/h5-9,14-15,19H,10-13,16H2,1-4H3,(H2,28,30)(H,29,32)