2-azanyl-2-[2-[(4-methoxyphenyl)carbonylamino]phenyl]sulfonyl-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-azanyl-2-[2-[(4-methoxyphenyl)carbonylamino]phenyl]sulfonyl-5-phenyl-pent-4-ynoic acid Openeye Name: 2-amino-2-[2-[(4-methoxybenzoyl)amino]phenyl]sulfonyl-5-phenyl-pent-4-ynoic acid CAS Name: 2-amino-2-[2-[[(4-methoxyphenyl)-oxomethyl]amino]phenyl]sulfonyl-5-phenyl-4-pentynoic acid IUPAC Name: 2-amino-2-[2-[(4-methoxybenzoyl)amino]phenyl]sulfonyl-5-phenylpent-4-ynoic acid Traditional Name: 2-amino-2-[2-(p-anisoylamino)phenyl]sulfonyl-5-phenyl-pent-4-ynoic acid Formula: C25H22N2O6S MolecularWeight: 478.51698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)C(CC#CC3=CC=CC=C3)(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)C(CC#CC3=CC=CC=C3)(C(=O)O)N

InChI

InChI=1S/C25H22N2O6S/c1-33-20-15-13-19(14-16-20)23(28)27-21-11-5-6-12-22(21)34(31,32)25(26,24(29)30)17-7-10-18-8-3-2-4-9-18/h2-6,8-9,11-16H,17,26H2,1H3,(H,27,28)(H,29,30)