methyl 4-[2-(1,3-benzothiazol-2-yl)ethylcarbamoyl]benzoate

Systemtic Name: methyl 4-[2-(1,3-benzothiazol-2-yl)ethylcarbamoyl]benzoate Openeye Name: methyl 4-[2-(1,3-benzothiazol-2-yl)ethylcarbamoyl]benzoate CAS Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1,3-benzothiazol-2-yl)ethylcarbamoyl]benzoate Traditional Name: 4-[2-(1,3-benzothiazol-2-yl)ethylcarbamoyl]benzoic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N2O3S/c1-23-18(22)13-8-6-12(7-9-13)17(21)19-11-10-16-20-14-4-2-3-5-15(14)24-16/h2-9H,10-11H2,1H3,(H,19,21)