17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene

Systemtic Name: 17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene Openeye Name: 17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene CAS Name: 17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene IUPAC Name: 17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene Traditional Name: 17-thia-3,6,9,12-tetrazabicyclo[12.2.1]heptadeca-1(16),14-diene Formula: C12H22N4S MolecularWeight: 254.39488

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCC2=CC=C(S2)CNCCN1

Isomeric SMILES

C1CNCCNCC2=CC=C(S2)CNCCN1

InChI

InChI=1S/C12H22N4S/c1-2-12-10-16-8-6-14-4-3-13-5-7-15-9-11(1)17-12/h1-2,13-16H,3-10H2