3-methyl-2-[(3-phenylthiophen-2-yl)carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(3-phenylthiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[(3-phenylthiophene-2-carbonyl)amino]butanoic acid CAS Name: 3-methyl-2-[[oxo-(3-phenyl-2-thiophenyl)methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(3-phenylthiophene-2-carbonyl)amino]butanoic acid Traditional Name: 3-methyl-2-[(3-phenylthiophene-2-carbonyl)amino]butyric acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=C(C=CS1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=C(C=CS1)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO3S/c1-10(2)13(16(19)20)17-15(18)14-12(8-9-21-14)11-6-4-3-5-7-11/h3-10,13H,1-2H3,(H,17,18)(H,19,20)