tert-butyl 2-[(phenylmethyl)amino]-2-sulfanylidene-ethanoate

Systemtic Name: tert-butyl 2-[(phenylmethyl)amino]-2-sulfanylidene-ethanoate Openeye Name: tert-butyl 2-(benzylamino)-2-thioxo-acetate CAS Name: 2-[(phenylmethyl)amino]-2-sulfanylideneacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(benzylamino)-2-sulfanylideneacetate Traditional Name: 2-(benzylamino)-2-thioxo-acetic acid tert-butyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=S)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)C(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C13H17NO2S/c1-13(2,3)16-12(15)11(17)14-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,14,17)