butyl 2-[(2-methoxy-3-methyl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[(2-methoxy-3-methyl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[(2-methoxy-3-methyl-benzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(2-methoxy-3-methylphenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[(2-methoxy-3-methylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(2-methoxy-3-methyl-benzoyl)amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=CC=C3)C)OC

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=CC=C3)C)OC

InChI

InChI=1S/C21H22N2O4S/c1-4-5-11-27-20(25)14-9-10-16-17(12-14)28-21(22-16)23-19(24)15-8-6-7-13(2)18(15)26-3/h6-10,12H,4-5,11H2,1-3H3,(H,22,23,24)