2-[[4-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butyl]-methoxycarbonyl-amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butyl]-methoxycarbonyl-amino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-4-oxo-butyl]-methoxycarbonyl-amino]-4-methyl-pentanoic acid CAS Name: 2-[[4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-4-oxobutyl]-methoxycarbonylamino]-4-methylpentanoic acid IUPAC Name: 2-[[4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-4-oxobutyl]-methoxycarbonylamino]-4-methylpentanoic acid Traditional Name: 2-[carbomethoxy-[4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-4-keto-butyl]amino]-4-methyl-valeric acid Formula: C19H24FN3O5S MolecularWeight: 425.474363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C19H24FN3O5S/c1-11(2)9-14(17(25)26)23(19(27)28-3)8-4-5-16(24)22-18-21-13-7-6-12(20)10-15(13)29-18/h6-7,10-11,14H,4-5,8-9H2,1-3H3,(H,25,26)(H,21,22,24)