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

Systemtic Name: tert-butyl 2-[(4-chloranyl-2-methyl-phenyl)carbamothioyl-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[(4-chloro-2-methyl-phenyl)carbamothioyl-methyl-amino]acetate CAS Name: 2-[[(4-chloro-2-methylanilino)-sulfanylidenemethyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-chloro-2-methylphenyl)carbamothioyl-methylamino]acetate Traditional Name: 2-[(4-chloro-2-methyl-phenyl)thiocarbamoyl-methyl-amino]acetic acid tert-butyl ester Formula: C15H21ClN2O2S MolecularWeight: 328.85744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=S)N(C)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=S)N(C)CC(=O)OC(C)(C)C

InChI

InChI=1S/C15H21ClN2O2S/c1-10-8-11(16)6-7-12(10)17-14(21)18(5)9-13(19)20-15(2,3)4/h6-8H,9H2,1-5H3,(H,17,21)