2-[2-(4-tert-butylphenoxy)ethanoylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-tert-butylphenoxy)ethanoylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-(4-tert-butylphenoxy)acetyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[[[2-(4-tert-butylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-tert-butylphenoxy)acetyl]carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-(4-tert-butylphenoxy)acetyl]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C20H25N3O3S2/c1-11-12(2)28-18(16(11)17(21)25)23-19(27)22-15(24)10-26-14-8-6-13(7-9-14)20(3,4)5/h6-9H,10H2,1-5H3,(H2,21,25)(H2,22,23,24,27)