methyl 2-[[1-[[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]carbamoylamino]cyclopentyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-[[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]carbamoylamino]cyclopentyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-[[4-(4-carbamimidoylphenoxy)-6-methyl-pyrimidin-2-yl]carbamoylamino]cyclopentanecarbonyl]amino]acetate CAS Name: 2-[[[1-[[[[4-(4-carbamimidoylphenoxy)-6-methyl-2-pyrimidinyl]amino]-oxomethyl]amino]cyclopentyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-[[4-(4-carbamimidoylphenoxy)-6-methylpyrimidin-2-yl]carbamoylamino]cyclopentanecarbonyl]amino]acetate Traditional Name: 2-[[1-[[4-(4-amidinophenoxy)-6-methyl-pyrimidin-2-yl]carbamoylamino]cyclopentanecarbonyl]amino]acetic acid methyl ester Formula: C22H27N7O5 MolecularWeight: 469.49368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NC2(CCCC2)C(=O)NCC(=O)OC)OC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NC2(CCCC2)C(=O)NCC(=O)OC)OC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H27N7O5/c1-13-11-16(34-15-7-5-14(6-8-15)18(23)24)27-20(26-13)28-21(32)29-22(9-3-4-10-22)19(31)25-12-17(30)33-2/h5-8,11H,3-4,9-10,12H2,1-2H3,(H3,23,24)(H,25,31)(H2,26,27,28,29,32)