(phenylmethyl) 2-cyclopentyl-2-[4-methylpent-4-enoyl-[2-methylpropyl(methylsulfonyl)amino]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-cyclopentyl-2-[4-methylpent-4-enoyl-[2-methylpropyl(methylsulfonyl)amino]amino]ethanoate Openeye Name: benzyl 2-cyclopentyl-2-[[isobutyl(methylsulfonyl)amino]-(4-methylpent-4-enoyl)amino]acetate CAS Name: 2-cyclopentyl-2-[(4-methyl-1-oxopent-4-enyl)-[2-methylpropyl(methylsulfonyl)amino]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-cyclopentyl-2-[4-methylpent-4-enoyl-[2-methylpropyl(methylsulfonyl)amino]amino]acetate Traditional Name: 2-cyclopentyl-2-[[isobutyl(mesyl)amino]-(4-methylpent-4-enoyl)amino]acetic acid benzyl ester Formula: C25H38N2O5S MolecularWeight: 478.64462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(N(C(C1CCCC1)C(=O)OCC2=CC=CC=C2)C(=O)CCC(=C)C)S(=O)(=O)C

Isomeric SMILES

CC(C)CN(N(C(C1CCCC1)C(=O)OCC2=CC=CC=C2)C(=O)CCC(=C)C)S(=O)(=O)C

InChI

InChI=1S/C25H38N2O5S/c1-19(2)15-16-23(28)27(26(17-20(3)4)33(5,30)31)24(22-13-9-10-14-22)25(29)32-18-21-11-7-6-8-12-21/h6-8,11-12,20,22,24H,1,9-10,13-18H2,2-5H3