ethyl 2-(tert-butylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(tert-butylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(tert-butylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(tert-butylamino)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(tert-butylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(tert-butylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(C)(C)C

InChI

InChI=1S/C18H22N2O2S2/c1-5-22-16(21)13-11-14(12-9-7-6-8-10-12)24-15(13)19-17(23)20-18(2,3)4/h6-11H,5H2,1-4H3,(H2,19,20,23)