3-[(4-tert-butylphenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-tert-butylphenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-tert-butylbenzoyl)-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(4-tert-butylphenyl)-oxomethyl]-methylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-tert-butylbenzoyl)-methylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-tert-butylbenzoyl)-methyl-amino]-5-phenyl-2-thenoic acid Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H23NO3S/c1-23(2,3)17-12-10-16(11-13-17)21(25)24(4)18-14-19(28-20(18)22(26)27)15-8-6-5-7-9-15/h5-14H,1-4H3,(H,26,27)