[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(butylamino)benzoate

Systemtic Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(butylamino)benzoate Openeye Name: [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl 2-(butylamino)benzoate CAS Name: 2-(butylamino)benzoic acid [2-(2,3-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(butylamino)benzoate Traditional Name: 2-(butylamino)benzoic acid [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1C(=O)OCC2=CSC(=N2)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCCCNC1=CC=CC=C1C(=O)OCC2=CSC(=N2)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C23H26N2O4S/c1-4-5-13-24-19-11-7-6-9-17(19)23(26)29-14-16-15-30-22(25-16)18-10-8-12-20(27-2)21(18)28-3/h6-12,15,24H,4-5,13-14H2,1-3H3