4-[3-(5-butylthiophen-2-yl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[3-(5-butylthiophen-2-yl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-(5-butyl-2-thienyl)-2H-isoxazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[3-(5-butyl-2-thiophenyl)-2H-isoxazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-(5-butylthiophen-2-yl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(5-butyl-2-thienyl)-3-isoxazolin-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C2=CC(=C3C=CC(=O)C=C3)ON2

Isomeric SMILES

CCCCC1=CC=C(S1)C2=CC(=C3C=CC(=O)C=C3)ON2

InChI

InChI=1S/C17H17NO2S/c1-2-3-4-14-9-10-17(21-14)15-11-16(20-18-15)12-5-7-13(19)8-6-12/h5-11,18H,2-4H2,1H3