2-[[4-[[methyl(phenyl)carbamoyl]amino]phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[[4-[[methyl(phenyl)carbamoyl]amino]phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-[[4-[[methyl(phenyl)carbamoyl]amino]phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid CAS Name: 2-[[4-[[(N-methylanilino)-oxomethyl]amino]phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid IUPAC Name: 2-[[4-[[methyl(phenyl)carbamoyl]amino]phenyl]sulfonylamino]-5-phenylpent-4-ynoic acid Traditional Name: 2-[[4-[[methyl(phenyl)carbamoyl]amino]phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H23N3O5S/c1-28(21-12-6-3-7-13-21)25(31)26-20-15-17-22(18-16-20)34(32,33)27-23(24(29)30)14-8-11-19-9-4-2-5-10-19/h2-7,9-10,12-13,15-18,23,27H,14H2,1H3,(H,26,31)(H,29,30)