2-[(2-methylphenyl)carbonylamino]-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate

Systemtic Name: 2-[(2-methylphenyl)carbonylamino]-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Openeye Name: 4-(4-isopropylphenyl)-2-[(2-methylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylate IUPAC Name: 2-[(2-methylbenzoyl)amino]-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Traditional Name: 2-(o-toluoylamino)-4-p-cumenyl-3-thenoate Formula: C22H20NO3S- MolecularWeight: 378.4641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)[O-]

InChI

InChI=1S/C22H21NO3S/c1-13(2)15-8-10-16(11-9-15)18-12-27-21(19(18)22(25)26)23-20(24)17-7-5-4-6-14(17)3/h4-13H,1-3H3,(H,23,24)(H,25,26)/p-1