[(2S)-butan-2-yl] 4-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: [(2S)-butan-2-yl] 4-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-butanoate Openeye Name: [(1S)-1-methylpropyl] 4-(1,3-benzothiazol-2-ylamino)-4-oxo-butanoate CAS Name: 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoate Traditional Name: 4-(1,3-benzothiazol-2-ylamino)-4-keto-butyric acid [(1S)-1-methylpropyl] ester Formula: C15H18N2O3S MolecularWeight: 306.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CCC(=O)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC[C@H](C)OC(=O)CCC(=O)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H18N2O3S/c1-3-10(2)20-14(19)9-8-13(18)17-15-16-11-6-4-5-7-12(11)21-15/h4-7,10H,3,8-9H2,1-2H3,(H,16,17,18)/t10-/m0/s1