3-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoylamino]-4-[(4-methyl-1-oxidanylidene-1-propan-2-yloxy-pentan-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoylamino]-4-[(4-methyl-1-oxidanylidene-1-propan-2-yloxy-pentan-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[3-[(4-carbamimidoylbenzoyl)amino]propanoylamino]-4-[(1-isopropoxycarbonyl-3-methyl-butyl)amino]-4-oxo-butanoic acid CAS Name: 3-[[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]-4-[(4-methyl-1-oxo-1-propan-2-yloxypentan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-[3-[(4-carbamimidoylbenzoyl)amino]propanoylamino]-4-[(4-methyl-1-oxo-1-propan-2-yloxypentan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-[3-[(4-amidinobenzoyl)amino]propanoylamino]-4-[(1-isopropoxycarbonyl-3-methyl-butyl)amino]-4-keto-butyric acid Formula: C24H35N5O7 MolecularWeight: 505.564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)C)NC(=O)C(CC(=O)O)NC(=O)CCNC(=O)C1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CC(C)CC(C(=O)OC(C)C)NC(=O)C(CC(=O)O)NC(=O)CCNC(=O)C1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C24H35N5O7/c1-13(2)11-18(24(35)36-14(3)4)29-23(34)17(12-20(31)32)28-19(30)9-10-27-22(33)16-7-5-15(6-8-16)21(25)26/h5-8,13-14,17-18H,9-12H2,1-4H3,(H3,25,26)(H,27,33)(H,28,30)(H,29,34)(H,31,32)