tert-butyl (E)-2-[(butylsulfonylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate

Systemtic Name: tert-butyl (E)-2-[(butylsulfonylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[(butylsulfonylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate CAS Name: (E)-2-[(butylsulfonylamino)-(4-methyl-1-oxopentyl)amino]-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[(butylsulfonylamino)-(4-methylpentanoyl)amino]-5-phenylpent-4-enoate Traditional Name: (E)-2-[(butylsulfonylamino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C25H40N2O5S MolecularWeight: 480.6605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NN(C(CC=CC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)CCC(C)C

Isomeric SMILES

CCCCS(=O)(=O)NN(C(C/C=C/C1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)CCC(C)C

InChI

InChI=1S/C25H40N2O5S/c1-7-8-19-33(30,31)26-27(23(28)18-17-20(2)3)22(24(29)32-25(4,5)6)16-12-15-21-13-10-9-11-14-21/h9-15,20,22,26H,7-8,16-19H2,1-6H3/b15-12+