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

Systemtic Name: (E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-(4-bromophenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-3-(4-bromophenyl)prop-2-enenitrile CAS Name: (E)-2-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-3-(4-bromophenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-(4-bromophenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-3-(4-bromophenyl)acrylonitrile Formula: C21H10Br2N2O2S MolecularWeight: 514.1893

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C(\C#N)/C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)Br

InChI

InChI=1S/C21H10Br2N2O2S/c22-15-3-1-12(2-4-15)7-14(10-24)20-25-18(11-28-20)17-9-13-8-16(23)5-6-19(13)27-21(17)26/h1-9,11H/b14-7+