tert-butyl 2-[(3-chlorophenyl)carbamothioyl-methyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[(3-chlorophenyl)carbamothioyl-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[(3-chlorophenyl)carbamothioyl-methyl-amino]acetate CAS Name: 2-[[(3-chloroanilino)-sulfanylidenemethyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3-chlorophenyl)carbamothioyl-methylamino]acetate Traditional Name: 2-[(3-chlorophenyl)thiocarbamoyl-methyl-amino]acetic acid tert-butyl ester Formula: C14H19ClN2O2S MolecularWeight: 314.83086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C)C(=S)NC1=CC(=CC=C1)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CN(C)C(=S)NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C14H19ClN2O2S/c1-14(2,3)19-12(18)9-17(4)13(20)16-11-7-5-6-10(15)8-11/h5-8H,9H2,1-4H3,(H,16,20)