methyl 2-[(4-tert-butylphenyl)carbonylcarbamothioylamino]ethanoate

Systemtic Name: methyl 2-[(4-tert-butylphenyl)carbonylcarbamothioylamino]ethanoate Openeye Name: methyl 2-[(4-tert-butylbenzoyl)carbamothioylamino]acetate CAS Name: 2-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-tert-butylbenzoyl)carbamothioylamino]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)thiocarbamoylamino]acetic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NCC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NCC(=O)OC

InChI

InChI=1S/C15H20N2O3S/c1-15(2,3)11-7-5-10(6-8-11)13(19)17-14(21)16-9-12(18)20-4/h5-8H,9H2,1-4H3,(H2,16,17,19,21)