ethyl 2-(3-isocyanatophenyl)sulfanylpropanoate

Systemtic Name: ethyl 2-(3-isocyanatophenyl)sulfanylpropanoate Openeye Name: ethyl 2-(3-isocyanatophenyl)sulfanylpropanoate CAS Name: 2-[(3-isocyanatophenyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-(3-isocyanatophenyl)sulfanylpropanoate Traditional Name: 2-[(3-isocyanatophenyl)thio]propionic acid ethyl ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=CC=CC(=C1)N=C=O

Isomeric SMILES

CCOC(=O)C(C)SC1=CC=CC(=C1)N=C=O

InChI

InChI=1S/C12H13NO3S/c1-3-16-12(15)9(2)17-11-6-4-5-10(7-11)13-8-14/h4-7,9H,3H2,1-2H3