4-(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(4-allyl-5-thioxo-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-allyl-5-thioxo-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C11H11N3OS MolecularWeight: 233.28954

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C2C=CC(=O)C=C2)NNC1=S

Isomeric SMILES

C=CCN1C(=C2C=CC(=O)C=C2)NNC1=S

InChI

InChI=1S/C11H11N3OS/c1-2-7-14-10(12-13-11(14)16)8-3-5-9(15)6-4-8/h2-6,12H,1,7H2,(H,13,16)