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

Systemtic Name: [3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-oxidanylidene-chromen-7-yl] cyclohexanecarboxylate Openeye Name: [3-[4-(4-bromophenyl)thiazol-2-yl]-2-oxo-chromen-7-yl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [3-[4-(4-bromophenyl)-2-thiazolyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-oxochromen-7-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [3-[4-(4-bromophenyl)thiazol-2-yl]-2-keto-chromen-7-yl] ester Formula: C25H20BrNO4S MolecularWeight: 510.3996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC(=CS4)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC(=CS4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H20BrNO4S/c26-18-9-6-15(7-10-18)21-14-32-23(27-21)20-12-17-8-11-19(13-22(17)31-25(20)29)30-24(28)16-4-2-1-3-5-16/h6-14,16H,1-5H2