methyl 4-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[5-(4-carbamimidoylphenyl)pyrimidine-2-carbonyl]amino]butanoate CAS Name: 4-[[[5-(4-carbamimidoylphenyl)-2-pyrimidinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[5-(4-carbamimidoylphenyl)pyrimidine-2-carbonyl]amino]butanoate Traditional Name: 4-[[5-(4-amidinophenyl)pyrimidine-2-carbonyl]amino]butyric acid methyl ester Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=NC=C(C=N1)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CCCNC(=O)C1=NC=C(C=N1)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H19N5O3/c1-25-14(23)3-2-8-20-17(24)16-21-9-13(10-22-16)11-4-6-12(7-5-11)15(18)19/h4-7,9-10H,2-3,8H2,1H3,(H3,18,19)(H,20,24)