3-[methyl(4-methylpentanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[methyl(4-methylpentanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[methyl(4-methylpentanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[methyl-(4-methyl-1-oxopentyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[methyl(4-methylpentanoyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[methyl(4-methylpentanoyl)amino]-5-phenyl-2-thenoic acid Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C)C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CCC(=O)N(C)C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H21NO3S/c1-12(2)9-10-16(20)19(3)14-11-15(23-17(14)18(21)22)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,21,22)