tert-butyl 2-[(3,4-dimethylphenyl)carbamothioyl-methyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[(3,4-dimethylphenyl)carbamothioyl-methyl-amino]ethanoate Openeye Name: tert-butyl 2-[(3,4-dimethylphenyl)carbamothioyl-methyl-amino]acetate CAS Name: 2-[[(3,4-dimethylanilino)-sulfanylidenemethyl]-methylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3,4-dimethylphenyl)carbamothioyl-methylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)thiocarbamoyl-methyl-amino]acetic acid tert-butyl ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2S/c1-11-7-8-13(9-12(11)2)17-15(21)18(6)10-14(19)20-16(3,4)5/h7-9H,10H2,1-6H3,(H,17,21)