(E)-2-[4-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]-1,3-thiazol-2-yl]-3-(4-chlorophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]-1,3-thiazol-2-yl]-3-(4-chlorophenyl)prop-2-enenitrile Openeye Name: (E)-3-(4-chlorophenyl)-2-[4-(6,8-dibromo-2-oxo-chromen-3-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: (E)-3-(4-chlorophenyl)-2-[4-(6,8-dibromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile IUPAC Name: (E)-3-(4-chlorophenyl)-2-[4-(6,8-dibromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: (E)-3-(4-chlorophenyl)-2-[4-(6,8-dibromo-2-keto-chromen-3-yl)thiazol-2-yl]acrylonitrile Formula: C21H9Br2ClN2O2S MolecularWeight: 548.63436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C2=NC(=CS2)C3=CC4=CC(=CC(=C4OC3=O)Br)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1/C=C(\C#N)/C2=NC(=CS2)C3=CC4=CC(=CC(=C4OC3=O)Br)Br)Cl

InChI

InChI=1S/C21H9Br2ClN2O2S/c22-14-6-12-7-16(21(27)28-19(12)17(23)8-14)18-10-29-20(26-18)13(9-25)5-11-1-3-15(24)4-2-11/h1-8,10H/b13-5+