ethyl 4-methyl-2-[[4-methyl-2-[(phenylmethyl)sulfonylamino]pentanoyl]amino]pentanoate

Systemtic Name: ethyl 4-methyl-2-[[4-methyl-2-[(phenylmethyl)sulfonylamino]pentanoyl]amino]pentanoate Openeye Name: ethyl 2-[[2-(benzylsulfonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoate CAS Name: 4-methyl-2-[[4-methyl-1-oxo-2-[(phenylmethyl)sulfonylamino]pentyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(benzylsulfonylamino)-4-methylpentanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-(benzylsulfonylamino)-4-methyl-pentanoyl]amino]-4-methyl-valeric acid ethyl ester Formula: C21H34N2O5S MolecularWeight: 426.57006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NS(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NS(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C21H34N2O5S/c1-6-28-21(25)19(13-16(4)5)22-20(24)18(12-15(2)3)23-29(26,27)14-17-10-8-7-9-11-17/h7-11,15-16,18-19,23H,6,12-14H2,1-5H3,(H,22,24)