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3-isothiocyanatobutanal

3-isothiocyanatobutanal

Systemtic Name:3-isothiocyanatobutanal
Openeye Name:3-isothiocyanatobutanal
CAS Name:3-isothiocyanatobutanal
IUPAC Name:3-isothiocyanatobutanal
Traditional Name:3-isothiocyanatobutyraldehyde
Formula: C5H7NOS
MolecularWeight: 129.18018
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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)N=C=S


Isomeric SMILES

CC(CC=O)N=C=S


InChI

InChI=1S/C5H7NOS/c1-5(2-3-7)6-4-8/h3,5H,2H2,1H3


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