(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C21H22N2O5S3 MolecularWeight: 478.60478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C21H22N2O5S3/c1-14-9-23(10-15(2)28-14)31(25,26)19-5-3-16(4-6-19)21(24)27-11-18-13-30-20(22-18)17-7-8-29-12-17/h3-8,12-15H,9-11H2,1-2H3