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

Systemtic Name: tert-butyl (E)-2-[4-methylpentanoyl-[phenyl-(phenylmethyl)sulfonyl-amino]amino]-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[(N-benzylsulfonylanilino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoate CAS Name: (E)-2-[(4-methyl-1-oxopentyl)-(N-(phenylmethyl)sulfonylanilino)amino]-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[(N-benzylsulfonylanilino)-(4-methylpentanoyl)amino]-5-phenylpent-4-enoate Traditional Name: (E)-2-[(N-benzylsulfonylanilino)-(4-methylpentanoyl)amino]-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C34H42N2O5S MolecularWeight: 590.77268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CC=CC1=CC=CC=C1)C(=O)OC(C)(C)C)N(C2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCC(=O)N(C(C/C=C/C1=CC=CC=C1)C(=O)OC(C)(C)C)N(C2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C34H42N2O5S/c1-27(2)24-25-32(37)35(31(33(38)41-34(3,4)5)23-15-20-28-16-9-6-10-17-28)36(30-21-13-8-14-22-30)42(39,40)26-29-18-11-7-12-19-29/h6-22,27,31H,23-26H2,1-5H3/b20-15+