[(2E,4E)-5-isocyanatopenta-2,4-dienyl]sulfanylbenzene

Systemtic Name: [(2E,4E)-5-isocyanatopenta-2,4-dienyl]sulfanylbenzene Openeye Name: [(2E,4E)-5-isocyanatopenta-2,4-dienyl]sulfanylbenzene CAS Name: [[(2E,4E)-5-isocyanatopenta-2,4-dienyl]thio]benzene IUPAC Name: [(2E,4E)-5-isocyanatopenta-2,4-dienyl]sulfanylbenzene Traditional Name: [[(2E,4E)-5-isocyanatopenta-2,4-dienyl]thio]benzene Formula: C12H11NOS MolecularWeight: 217.28684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC=CC=CN=C=O

Isomeric SMILES

C1=CC=C(C=C1)SC/C=C/C=C/N=C=O

InChI

InChI=1S/C12H11NOS/c14-11-13-9-5-2-6-10-15-12-7-3-1-4-8-12/h1-9H,10H2/b6-2+,9-5+