[3-[[2-[ethanoyl-(4-methylphenyl)sulfonyl-amino]-4-methyl-pentanoyl]amino]oxolan-2-yl] ethanoate

Systemtic Name: [3-[[2-[ethanoyl-(4-methylphenyl)sulfonyl-amino]-4-methyl-pentanoyl]amino]oxolan-2-yl] ethanoate Openeye Name: [3-[[2-[acetyl(p-tolylsulfonyl)amino]-4-methyl-pentanoyl]amino]tetrahydrofuran-2-yl] acetate CAS Name: acetic acid [3-[[2-[acetyl-(4-methylphenyl)sulfonylamino]-4-methyl-1-oxopentyl]amino]-2-oxolanyl] ester IUPAC Name: [3-[[2-[acetyl-(4-methylphenyl)sulfonylamino]-4-methylpentanoyl]amino]oxolan-2-yl] acetate Traditional Name: acetic acid [3-[[2-[acetyl(tosyl)amino]-4-methyl-pentanoyl]amino]tetrahydrofuran-2-yl] ester Formula: C21H30N2O7S MolecularWeight: 454.5371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(CC(C)C)C(=O)NC2CCOC2OC(=O)C)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C(CC(C)C)C(=O)NC2CCOC2OC(=O)C)C(=O)C

InChI

InChI=1S/C21H30N2O7S/c1-13(2)12-19(20(26)22-18-10-11-29-21(18)30-16(5)25)23(15(4)24)31(27,28)17-8-6-14(3)7-9-17/h6-9,13,18-19,21H,10-12H2,1-5H3,(H,22,26)