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

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-ethanoyl-amino]ethyl benzoate Openeye Name: 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-anilino]ethyl benzoate CAS Name: benzoic 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 benzoate Traditional Name: benzoic acid 2-[N-acetyl-4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-anilino]ethyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(CCOC(=O)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(CCOC(=O)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C26H24N2O4S/c1-18-16-21(32-17-25-27-22-10-6-7-11-24(22)33-25)12-13-23(18)28(19(2)29)14-15-31-26(30)20-8-4-3-5-9-20/h3-13,16H,14-15,17H2,1-2H3