(E)-4-(1-benzothiophen-5-yl)but-3-en-2-one

Systemtic Name: (E)-4-(1-benzothiophen-5-yl)but-3-en-2-one Openeye Name: (E)-4-(benzothiophen-5-yl)but-3-en-2-one CAS Name: (E)-4-(1-benzothiophen-5-yl)-3-buten-2-one IUPAC Name: (E)-4-(1-benzothiophen-5-yl)but-3-en-2-one Traditional Name: (E)-4-(benzothiophen-5-yl)but-3-en-2-one Formula: C12H10OS MolecularWeight: 202.2722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CC2=C(C=C1)SC=C2

Isomeric SMILES

CC(=O)/C=C/C1=CC2=C(C=C1)SC=C2

InChI

InChI=1S/C12H10OS/c1-9(13)2-3-10-4-5-12-11(8-10)6-7-14-12/h2-8H,1H3/b3-2+