(5-isothiocyanatopyridin-2-yl) N-methyl-N-phenyl-carbamate

Systemtic Name: (5-isothiocyanatopyridin-2-yl) N-methyl-N-phenyl-carbamate Openeye Name: (5-isothiocyanato-2-pyridyl) N-methyl-N-phenyl-carbamate CAS Name: N-methyl-N-phenylcarbamic acid (5-isothiocyanato-2-pyridinyl) ester IUPAC Name: (5-isothiocyanatopyridin-2-yl) N-methyl-N-phenylcarbamate Traditional Name: N-methyl-N-phenyl-carbamic acid (5-isothiocyanato-2-pyridyl) ester Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)OC2=NC=C(C=C2)N=C=S

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)OC2=NC=C(C=C2)N=C=S

InChI

InChI=1S/C14H11N3O2S/c1-17(12-5-3-2-4-6-12)14(18)19-13-8-7-11(9-15-13)16-10-20/h2-9H,1H3