4-methyl-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[4-(3-nitrophenyl)thiazol-2-yl]amino]pentanoic acid CAS Name: 4-methyl-2-[[4-(3-nitrophenyl)-2-thiazolyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[4-(3-nitrophenyl)thiazol-2-yl]amino]valeric acid Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4S/c1-9(2)6-12(14(19)20)16-15-17-13(8-23-15)10-4-3-5-11(7-10)18(21)22/h3-5,7-9,12H,6H2,1-2H3,(H,16,17)(H,19,20)