(phenylmethyl) 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoate

Systemtic Name: (phenylmethyl) 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoate Openeye Name: benzyl 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-oxo-acetate CAS Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-oxoacetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-oxoacetate Traditional Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-1,3-benzothiazol-2-yl)amino]-2-keto-acetic acid benzyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1)SC(=N2)NC(=O)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1(CCC2=C(C1)SC(=N2)NC(=O)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C18H20N2O3S/c1-18(2)9-8-13-14(10-18)24-17(19-13)20-15(21)16(22)23-11-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,19,20,21)