2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-methyl-propanoic acid Openeye Name: 2-[4-[[4-(4-carbamimidoylphenyl)thiazol-2-yl]amino]-1-piperidyl]-2-methyl-propanoic acid CAS Name: 2-[4-[[4-(4-carbamimidoylphenyl)-2-thiazolyl]amino]-1-piperidinyl]-2-methylpropanoic acid IUPAC Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-methylpropanoic acid Traditional Name: 2-[4-[[4-(4-amidinophenyl)thiazol-2-yl]amino]piperidino]-2-methyl-propionic acid Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)N1CCC(CC1)NC2=NC(=CS2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)(C(=O)O)N1CCC(CC1)NC2=NC(=CS2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H25N5O2S/c1-19(2,17(25)26)24-9-7-14(8-10-24)22-18-23-15(11-27-18)12-3-5-13(6-4-12)16(20)21/h3-6,11,14H,7-10H2,1-2H3,(H3,20,21)(H,22,23)(H,25,26)