[3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-hexyl-2-oxidanylidene-chromen-7-yl] ethanoate

Systemtic Name: [3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-hexyl-2-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [3-[4-(4-bromophenyl)thiazol-2-yl]-6-hexyl-2-oxo-chromen-7-yl] acetate CAS Name: acetic acid [3-[4-(4-bromophenyl)-2-thiazolyl]-6-hexyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-6-hexyl-2-oxochromen-7-yl] acetate Traditional Name: acetic acid [3-[4-(4-bromophenyl)thiazol-2-yl]-6-hexyl-2-keto-chromen-7-yl] ester Formula: C26H24BrNO4S MolecularWeight: 526.44206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NC(=CS3)C4=CC=C(C=C4)Br)OC(=O)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NC(=CS3)C4=CC=C(C=C4)Br)OC(=O)C

InChI

InChI=1S/C26H24BrNO4S/c1-3-4-5-6-7-18-12-19-13-21(26(30)32-24(19)14-23(18)31-16(2)29)25-28-22(15-33-25)17-8-10-20(27)11-9-17/h8-15H,3-7H2,1-2H3