4-propyl-7-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methoxy]chromen-2-one

Systemtic Name: 4-propyl-7-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methoxy]chromen-2-one Openeye Name: 4-propyl-7-[[2-(2-pyridyl)thiazol-4-yl]methoxy]chromen-2-one CAS Name: 4-propyl-7-[[2-(2-pyridinyl)-4-thiazolyl]methoxy]-1-benzopyran-2-one IUPAC Name: 4-propyl-7-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methoxy]chromen-2-one Traditional Name: 4-propyl-7-[[2-(2-pyridyl)thiazol-4-yl]methoxy]coumarin Formula: C21H18N2O3S MolecularWeight: 378.44422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C21H18N2O3S/c1-2-5-14-10-20(24)26-19-11-16(7-8-17(14)19)25-12-15-13-27-21(23-15)18-6-3-4-9-22-18/h3-4,6-11,13H,2,5,12H2,1H3