(E)-2-[hexanoyl-[methylsulfonyl(phenyl)amino]amino]-5-phenyl-pent-4-enoic acid

Systemtic Name: (E)-2-[hexanoyl-[methylsulfonyl(phenyl)amino]amino]-5-phenyl-pent-4-enoic acid Openeye Name: (E)-2-[hexanoyl-(N-methylsulfonylanilino)amino]-5-phenyl-pent-4-enoic acid CAS Name: (E)-2-[(N-methylsulfonylanilino)-(1-oxohexyl)amino]-5-phenyl-4-pentenoic acid IUPAC Name: (E)-2-[hexanoyl-(N-methylsulfonylanilino)amino]-5-phenylpent-4-enoic acid Traditional Name: (E)-2-[caproyl-(N-mesylanilino)amino]-5-phenyl-pent-4-enoic acid Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(C(CC=CC1=CC=CC=C1)C(=O)O)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCCCC(=O)N(C(C/C=C/C1=CC=CC=C1)C(=O)O)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C24H30N2O5S/c1-3-4-7-19-23(27)25(26(32(2,30)31)21-16-10-6-11-17-21)22(24(28)29)18-12-15-20-13-8-5-9-14-20/h5-6,8-17,22H,3-4,7,18-19H2,1-2H3,(H,28,29)/b15-12+