3-[aminocarbonyl-(4-methylphenyl)amino]-5-tert-butyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[aminocarbonyl-(4-methylphenyl)amino]-5-tert-butyl-thiophene-2-carboxylic acid Openeye Name: 5-tert-butyl-3-(N-carbamoyl-4-methyl-anilino)thiophene-2-carboxylic acid CAS Name: 5-tert-butyl-3-(N-carbamoyl-4-methylanilino)-2-thiophenecarboxylic acid IUPAC Name: 5-tert-butyl-3-(N-carbamoyl-4-methylanilino)thiophene-2-carboxylic acid Traditional Name: 5-tert-butyl-3-(N-carbamoyl-4-methyl-anilino)-2-thenoic acid Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=C(SC(=C2)C(C)(C)C)C(=O)O)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=C(SC(=C2)C(C)(C)C)C(=O)O)C(=O)N

InChI

InChI=1S/C17H20N2O3S/c1-10-5-7-11(8-6-10)19(16(18)22)12-9-13(17(2,3)4)23-14(12)15(20)21/h5-9H,1-4H3,(H2,18,22)(H,20,21)