4-[(4-methylphenyl)carbonyl-(thiophen-2-ylmethyl)amino]benzoic acid

Systemtic Name: 4-[(4-methylphenyl)carbonyl-(thiophen-2-ylmethyl)amino]benzoic acid Openeye Name: 4-[(4-methylbenzoyl)-(2-thienylmethyl)amino]benzoic acid CAS Name: 4-[[(4-methylphenyl)-oxomethyl]-(thiophen-2-ylmethyl)amino]benzoic acid IUPAC Name: 4-[(4-methylbenzoyl)-(thiophen-2-ylmethyl)amino]benzoic acid Traditional Name: 4-[p-toluoyl(2-thenyl)amino]benzoic acid Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H17NO3S/c1-14-4-6-15(7-5-14)19(22)21(13-18-3-2-12-25-18)17-10-8-16(9-11-17)20(23)24/h2-12H,13H2,1H3,(H,23,24)