[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylindole-3-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylindole-3-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 1-ethylindole-3-carboxylate CAS Name: 1-ethyl-3-indolecarboxylic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-ethylindole-3-carboxylate Traditional Name: 1-ethylindole-3-carboxylic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(=O)OCC3=CSC(=N3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(=O)OCC3=CSC(=N3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C23H22N2O4S/c1-4-25-12-18(17-7-5-6-8-19(17)25)23(26)29-13-16-14-30-22(24-16)15-9-10-20(27-2)21(11-15)28-3/h5-12,14H,4,13H2,1-3H3