[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C15H18N2O3S2 MolecularWeight: 338.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)CSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)CNC(=O)COC(=O)CSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H18N2O3S2/c1-10(2)7-16-13(18)8-20-14(19)9-21-15-17-11-5-3-4-6-12(11)22-15/h3-6,10H,7-9H2,1-2H3,(H,16,18)