methyl (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-methyl-valeric acid methyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H18N2O4S/c1-9(2)8-11(14(17)20-3)15-13-10-6-4-5-7-12(10)21(18,19)16-13/h4-7,9,11H,8H2,1-3H3,(H,15,16)/t11-/m0/s1