tetrabutylazanium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: tetrabutylazanium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: tetrabutylammonium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: tetrabutylammonium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: tetrabutylazanium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: tetrabutylammonium; (6E)-6-(3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C24H42N3OS+ MolecularWeight: 420.67478

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C2NN=CS2)C(=O)C=C1

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=C/C(=C\2/NN=CS2)/C(=O)C=C1

InChI

InChI=1S/C16H36N.C8H6N2OS/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;11-7-4-2-1-3-6(7)8-10-9-5-12-8/h5-16H2,1-4H3;1-5,10H/q+1;/b;8-6+