2-[[3-[(4-methylphenyl)sulfonylamino]-5-phenyl-thiophen-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(4-methylphenyl)sulfonylamino]-5-phenyl-thiophen-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-phenyl-3-(p-tolylsulfonylamino)thiophene-2-carbonyl]amino]acetic acid CAS Name: 2-[[[3-[(4-methylphenyl)sulfonylamino]-5-phenyl-2-thiophenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3-[(4-methylphenyl)sulfonylamino]-5-phenylthiophene-2-carbonyl]amino]acetic acid Traditional Name: 2-[[5-phenyl-3-(tosylamino)thiophene-2-carbonyl]amino]acetic acid Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)NCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)NCC(=O)O

InChI

InChI=1S/C20H18N2O5S2/c1-13-7-9-15(10-8-13)29(26,27)22-16-11-17(14-5-3-2-4-6-14)28-19(16)20(25)21-12-18(23)24/h2-11,22H,12H2,1H3,(H,21,25)(H,23,24)