2-tert-butylsulfonylprop-2-enyl 3-[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]oxy-3-methyl-butanoate

Systemtic Name: 2-tert-butylsulfonylprop-2-enyl 3-[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]oxy-3-methyl-butanoate Openeye Name: 2-tert-butylsulfonylallyl 3-[2-[(2-amino-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]oxy-3-methyl-butanoate CAS Name: 3-[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxo-3-phenylpropoxy]-3-methylbutanoic acid 2-tert-butylsulfonylprop-2-enyl ester IUPAC Name: 2-tert-butylsulfonylprop-2-enyl 3-[2-[(2-amino-3-phenylpropanoyl)amino]-3-phenylpropanoyl]oxy-3-methylbutanoate Traditional Name: 3-methyl-3-[3-phenyl-2-(phenylalanylamino)propanoyl]oxy-butyric acid 2-tert-butylsulfonylallyl ester Formula: C30H40N2O7S MolecularWeight: 572.7128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C(=C)COC(=O)CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)S(=O)(=O)C(=C)COC(=O)CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C30H40N2O7S/c1-21(40(36,37)29(2,3)4)20-38-26(33)19-30(5,6)39-28(35)25(18-23-15-11-8-12-16-23)32-27(34)24(31)17-22-13-9-7-10-14-22/h7-16,24-25H,1,17-20,31H2,2-6H3,(H,32,34)