2-[2-azanylethanoyl(cyclopropyl)amino]-N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-2-cyclohexyl-ethanamide

Systemtic Name: 2-[2-azanylethanoyl(cyclopropyl)amino]-N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-2-cyclohexyl-ethanamide Openeye Name: 2-[(2-aminoacetyl)-cyclopropyl-amino]-N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-2-cyclohexyl-acetamide CAS Name: 2-[(2-amino-1-oxoethyl)-cyclopropylamino]-N-[(4-carbamimidoyl-2-methoxyphenyl)methyl]-2-cyclohexylacetamide IUPAC Name: 2-[(2-aminoacetyl)-cyclopropylamino]-N-[(4-carbamimidoyl-2-methoxyphenyl)methyl]-2-cyclohexylacetamide Traditional Name: N-(4-amidino-2-methoxy-benzyl)-2-cyclohexyl-2-[cyclopropyl(glycyl)amino]acetamide Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C(C2CCCCC2)N(C3CC3)C(=O)CN

Isomeric SMILES

COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C(C2CCCCC2)N(C3CC3)C(=O)CN

InChI

InChI=1S/C22H33N5O3/c1-30-18-11-15(21(24)25)7-8-16(18)13-26-22(29)20(14-5-3-2-4-6-14)27(17-9-10-17)19(28)12-23/h7-8,11,14,17,20H,2-6,9-10,12-13,23H2,1H3,(H3,24,25)(H,26,29)