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

Systemtic Name: (3E)-2-[(2-bromanylthiophen-3-yl)methyl]-3-butylidene-isoindol-1-one Openeye Name: (3E)-2-[(2-bromo-3-thienyl)methyl]-3-butylidene-isoindolin-1-one CAS Name: (3E)-2-[(2-bromo-3-thiophenyl)methyl]-3-butylidene-1-isoindolone IUPAC Name: (3E)-2-[(2-bromothiophen-3-yl)methyl]-3-butylideneisoindol-1-one Traditional Name: (3E)-2-[(2-bromo-3-thienyl)methyl]-3-butylidene-isoindolin-1-one Formula: C17H16BrNOS MolecularWeight: 362.28404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C1C2=CC=CC=C2C(=O)N1CC3=C(SC=C3)Br

Isomeric SMILES

CCC/C=C/1\C2=CC=CC=C2C(=O)N1CC3=C(SC=C3)Br

InChI

InChI=1S/C17H16BrNOS/c1-2-3-8-15-13-6-4-5-7-14(13)17(20)19(15)11-12-9-10-21-16(12)18/h4-10H,2-3,11H2,1H3/b15-8+