[2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-methoxyethanoate

Systemtic Name: [2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-methoxyethanoate Openeye Name: [2-[benzyl-(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl-(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [2-[benzyl-(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)COC(=O)COC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)COC(=O)COC)C

InChI

InChI=1S/C21H22N2O4S/c1-14-9-10-17-20(15(14)2)22-21(28-17)23(11-16-7-5-4-6-8-16)18(24)12-27-19(25)13-26-3/h4-10H,11-13H2,1-3H3