3-chloranyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane

Systemtic Name: 3-chloranyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane Openeye Name: 3-chloro-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane CAS Name: 3-chloro-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane IUPAC Name: 3-chloro-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane Traditional Name: 3-chloro-7-thiabicyclo[2.2.1]hepta-1,3,5-triene; 1-isocyanatopropane Formula: C10H10ClNOS MolecularWeight: 227.7105

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C=O.C1=CC2=C(C=C1S2)Cl

Isomeric SMILES

CCCN=C=O.C1=CC2=C(C=C1S2)Cl

InChI

InChI=1S/C6H3ClS.C4H7NO/c7-5-3-4-1-2-6(5)8-4;1-2-3-5-4-6/h1-3H;2-3H2,1H3