6-chloranyl-7-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methoxy]-4-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-7-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methoxy]-4-methyl-chromen-2-one Openeye Name: 6-chloro-7-[[2-(3-methoxyphenyl)thiazol-4-yl]methoxy]-4-methyl-chromen-2-one CAS Name: 6-chloro-7-[[2-(3-methoxyphenyl)-4-thiazolyl]methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-7-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methoxy]-4-methylchromen-2-one Traditional Name: 6-chloro-7-[[2-(3-methoxyphenyl)thiazol-4-yl]methoxy]-4-methyl-coumarin Formula: C21H16ClNO4S MolecularWeight: 413.87404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=CSC(=N3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=CSC(=N3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C21H16ClNO4S/c1-12-6-20(24)27-18-9-19(17(22)8-16(12)18)26-10-14-11-28-21(23-14)13-4-3-5-15(7-13)25-2/h3-9,11H,10H2,1-2H3