3-methylbutyl 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate

Systemtic Name: 3-methylbutyl 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: isopentyl 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate CAS Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate Traditional Name: 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid isoamyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)CCOC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C15H20N2O4S/c1-11(2)8-10-21-14(18)7-9-16-15-12-5-3-4-6-13(12)22(19,20)17-15/h3-6,11H,7-10H2,1-2H3,(H,16,17)