3-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]chromen-2-one

Systemtic Name: 3-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]chromen-2-one Openeye Name: 3-[4-(4-butoxyphenyl)thiazol-2-yl]chromen-2-one CAS Name: 3-[4-(4-butoxyphenyl)-2-thiazolyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]chromen-2-one Traditional Name: 3-[4-(4-butoxyphenyl)thiazol-2-yl]coumarin Formula: C22H19NO3S MolecularWeight: 377.45616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H19NO3S/c1-2-3-12-25-17-10-8-15(9-11-17)19-14-27-21(23-19)18-13-16-6-4-5-7-20(16)26-22(18)24/h4-11,13-14H,2-3,12H2,1H3