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4-(carbamothioylamino)-N-(furan-2-ylmethyl)benzonitrilium

4-(carbamothioylamino)-N-(furan-2-ylmethyl)benzonitrilium

Systemtic Name:4-(carbamothioylamino)-N-(furan-2-ylmethyl)benzonitrilium
Openeye Name:4-(carbamothioylamino)-N-(2-furylmethyl)benzonitrilium
CAS Name:4-(carbamothioylamino)-N-(2-furanylmethyl)benzonitrilium
IUPAC Name:4-(carbamothioylamino)-N-(furan-2-ylmethyl)benzonitrilium
Traditional Name:N-(2-furfuryl)-4-thioureido-benzonitrilium
Formula: C13H12N3OS+
MolecularWeight: 258.31888
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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C[N+]#CC2=CC=C(C=C2)NC(=S)N


Isomeric SMILES

C1=COC(=C1)C[N+]#CC2=CC=C(C=C2)NC(=S)N


InChI

InChI=1S/C13H11N3OS/c14-13(18)16-11-5-3-10(4-6-11)8-15-9-12-2-1-7-17-12/h1-7H,9H2,(H2,14,18)/p+1


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