(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 6-chlorochromane-3-carboxylate CAS Name: 6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: 6-chlorochroman-3-carboxylic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C18H14ClNO3S2 MolecularWeight: 391.89166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)Cl)C(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1C(COC2=C1C=C(C=C2)Cl)C(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C18H14ClNO3S2/c19-14-1-2-16-12(6-14)5-13(7-22-16)18(21)23-8-15-10-25-17(20-15)11-3-4-24-9-11/h1-4,6,9-10,13H,5,7-8H2