methyl 2-[2-[(3-cyanophenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(3-cyanophenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(3-cyanophenyl)sulfonylamino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C16H21N3O5S/c1-11(2)7-14(16(21)24-3)19-15(20)10-18-25(22,23)13-6-4-5-12(8-13)9-17/h4-6,8,11,14,18H,7,10H2,1-3H3,(H,19,20)