6-bromanyl-3-[2-[(4-propoxyphenyl)amino]-1,3-thiazol-4-yl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[2-[(4-propoxyphenyl)amino]-1,3-thiazol-4-yl]chromen-2-one Openeye Name: 6-bromo-3-[2-(4-propoxyanilino)thiazol-4-yl]chromen-2-one CAS Name: 6-bromo-3-[2-(4-propoxyanilino)-4-thiazolyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[2-(4-propoxyanilino)-1,3-thiazol-4-yl]chromen-2-one Traditional Name: 6-bromo-3-[2-(4-propoxyanilino)thiazol-4-yl]coumarin Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C21H17BrN2O3S/c1-2-9-26-16-6-4-15(5-7-16)23-21-24-18(12-28-21)17-11-13-10-14(22)3-8-19(13)27-20(17)25/h3-8,10-12H,2,9H2,1H3,(H,23,24)