[2-[(4-methyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-ethoxyethanoate

Systemtic Name: [2-[(4-methyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-ethoxyethanoate Openeye Name: [2-[benzyl-(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-ethoxyacetate CAS Name: 2-ethoxyacetic acid [2-[(4-methyl-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl-(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-ethoxyacetate Traditional Name: 2-ethoxyacetic acid [2-[benzyl-(4-methyl-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:

CCOCC(=O)OCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(C=CC=C3S2)C

Isomeric SMILES

CCOCC(=O)OCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(C=CC=C3S2)C

InChI

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