2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide

Systemtic Name: 2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide Openeye Name: 2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide CAS Name: 2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide IUPAC Name: 2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide Traditional Name: 2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carbothioamide Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOC2=C(C=CC(=C2)C(=S)N)OCCO1

Isomeric SMILES

C1COCCOC2=C(C=CC(=C2)C(=S)N)OCCO1

InChI

InChI=1S/C13H17NO4S/c14-13(19)10-1-2-11-12(9-10)18-8-6-16-4-3-15-5-7-17-11/h1-2,9H,3-8H2,(H2,14,19)