(3E)-2-[(2-bromanylthiophen-3-yl)methyl]-3-phenacylidene-isoindol-1-one

Systemtic Name: (3E)-2-[(2-bromanylthiophen-3-yl)methyl]-3-phenacylidene-isoindol-1-one Openeye Name: (3E)-2-[(2-bromo-3-thienyl)methyl]-3-phenacylidene-isoindolin-1-one CAS Name: (3E)-2-[(2-bromo-3-thiophenyl)methyl]-3-phenacylidene-1-isoindolone IUPAC Name: (3E)-2-[(2-bromothiophen-3-yl)methyl]-3-phenacylideneisoindol-1-one Traditional Name: (3E)-2-[(2-bromo-3-thienyl)methyl]-3-phenacylidene-isoindolin-1-one Formula: C21H14BrNO2S MolecularWeight: 424.31036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=C2C3=CC=CC=C3C(=O)N2CC4=C(SC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=C/2\C3=CC=CC=C3C(=O)N2CC4=C(SC=C4)Br

InChI

InChI=1S/C21H14BrNO2S/c22-20-15(10-11-26-20)13-23-18(12-19(24)14-6-2-1-3-7-14)16-8-4-5-9-17(16)21(23)25/h1-12H,13H2/b18-12+