methyl 2-[2-(1,3-benzothiazol-2-ylcarbamoyl)phenyl]benzoate

Systemtic Name: methyl 2-[2-(1,3-benzothiazol-2-ylcarbamoyl)phenyl]benzoate Openeye Name: methyl 2-[2-(1,3-benzothiazol-2-ylcarbamoyl)phenyl]benzoate CAS Name: 2-[2-[(1,3-benzothiazol-2-ylamino)-oxomethyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-benzothiazol-2-ylcarbamoyl)phenyl]benzoate Traditional Name: 2-[2-(1,3-benzothiazol-2-ylcarbamoyl)phenyl]benzoic acid methyl ester Formula: C22H16N2O3S MolecularWeight: 388.43904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC=CC=C2C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC=CC=C2C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H16N2O3S/c1-27-21(26)17-11-5-3-9-15(17)14-8-2-4-10-16(14)20(25)24-22-23-18-12-6-7-13-19(18)28-22/h2-13H,1H3,(H,23,24,25)