3-[2-[4-(4-carbamimidoylphenyl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: 3-[2-[4-(4-carbamimidoylphenyl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: 3-[[2-[4-(4-carbamimidoylphenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[4-(4-carbamimidoylphenyl)-4-methyl-2,5-dioxo-1-imidazolidinyl]-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: 3-[[2-[4-(4-carbamimidoylphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[4-(4-amidinophenyl)-2,5-diketo-4-methyl-imidazolidin-1-yl]acetyl]amino]-3-phenyl-propionate Formula: C22H22N5O5- MolecularWeight: 436.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CC(=O)NC(CC(=O)[O-])C2=CC=CC=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CC(=O)NC(CC(=O)[O-])C2=CC=CC=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H23N5O5/c1-22(15-9-7-14(8-10-15)19(23)24)20(31)27(21(32)26-22)12-17(28)25-16(11-18(29)30)13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3,(H3,23,24)(H,25,28)(H,26,32)(H,29,30)/p-1