2-[[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-ethanoyl-amino]ethyl ethanoate

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-ethanoyl-amino]ethyl ethanoate Openeye Name: 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-anilino]ethyl acetate CAS Name: acetic acid 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methylanilino]ethyl ester IUPAC Name: 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methylanilino]ethyl acetate Traditional Name: acetic acid 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-anilino]ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(CCOC(=O)C)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(CCOC(=O)C)C(=O)C

InChI

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