3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione

Systemtic Name: 3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione Openeye Name: 3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione CAS Name: 3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione IUPAC Name: 3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione Traditional Name: 3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14-diene-16-thione Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCC2=CC(=S)C=C(N2)COCCO1

Isomeric SMILES

C1COCCOCC2=CC(=S)C=C(N2)COCCO1

InChI

InChI=1S/C13H19NO4S/c19-13-7-11-9-17-5-3-15-1-2-16-4-6-18-10-12(8-13)14-11/h7-8H,1-6,9-10H2,(H,14,19)