tert-butyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl-methyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl-methyl-amino]acetate CAS Name: 2-[[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl-methylamino]acetate Traditional Name: 2-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl-methyl-amino]acetic acid tert-butyl ester Formula: C16H23ClN2O4S MolecularWeight: 374.88282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C)C(=S)NC1=CC(=C(C=C1OC)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)CN(C)C(=S)NC1=CC(=C(C=C1OC)Cl)OC

InChI

InChI=1S/C16H23ClN2O4S/c1-16(2,3)23-14(20)9-19(4)15(24)18-11-8-12(21-5)10(17)7-13(11)22-6/h7-8H,9H2,1-6H3,(H,18,24)