8-bromanyl-3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitro-chromen-2-one

Systemtic Name: 8-bromanyl-3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitro-chromen-2-one Openeye Name: 8-bromo-3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-6-nitro-chromen-2-one CAS Name: 8-bromo-3-[2-(2,4-dimethylphenyl)-4-thiazolyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 8-bromo-3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitrochromen-2-one Traditional Name: 8-bromo-3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-6-nitro-coumarin Formula: C20H13BrN2O4S MolecularWeight: 457.29722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=CC(=C4OC3=O)Br)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=CC(=C4OC3=O)Br)[N+](=O)[O-])C

InChI

InChI=1S/C20H13BrN2O4S/c1-10-3-4-14(11(2)5-10)19-22-17(9-28-19)15-7-12-6-13(23(25)26)8-16(21)18(12)27-20(15)24/h3-9H,1-2H3