2-[(5-methyl-2-oxidanylidene-hexan-3-yl)amino]-3-(2-phenyl-1,3-thiazol-4-yl)propanoic acid

Systemtic Name: 2-[(5-methyl-2-oxidanylidene-hexan-3-yl)amino]-3-(2-phenyl-1,3-thiazol-4-yl)propanoic acid Openeye Name: 2-[(1-acetyl-3-methyl-butyl)amino]-3-(2-phenylthiazol-4-yl)propanoic acid CAS Name: 2-[(5-methyl-2-oxohexan-3-yl)amino]-3-(2-phenyl-4-thiazolyl)propanoic acid IUPAC Name: 2-[(5-methyl-2-oxohexan-3-yl)amino]-3-(2-phenyl-1,3-thiazol-4-yl)propanoic acid Traditional Name: 2-[(1-acetyl-3-methyl-butyl)amino]-3-(2-phenylthiazol-4-yl)propionic acid Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C)NC(CC1=CSC(=N1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)C)NC(CC1=CSC(=N1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H24N2O3S/c1-12(2)9-16(13(3)22)21-17(19(23)24)10-15-11-25-18(20-15)14-7-5-4-6-8-14/h4-8,11-12,16-17,21H,9-10H2,1-3H3,(H,23,24)