1,3-benzothiazol-2-ylmethyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H18N2O4S2/c1-12-7-8-14(9-13(12)2)26(22,23)19-10-18(21)24-11-17-20-15-5-3-4-6-16(15)25-17/h3-9,19H,10-11H2,1-2H3