N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]propanamide Openeye Name: N-[4-(isothiocyanatomethyl)thiazol-2-yl]propanamide CAS Name: N-[4-(isothiocyanatomethyl)-2-thiazolyl]propanamide IUPAC Name: N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]propanamide Traditional Name: N-[4-(isothiocyanatomethyl)thiazol-2-yl]propionamide Formula: C8H9N3OS2 MolecularWeight: 227.30656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=CS1)CN=C=S

Isomeric SMILES

CCC(=O)NC1=NC(=CS1)CN=C=S

InChI

InChI=1S/C8H9N3OS2/c1-2-7(12)11-8-10-6(4-14-8)3-9-5-13/h4H,2-3H2,1H3,(H,10,11,12)