methyl 2-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(5-tert-butyl-2-hydroxy-phenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[(5-tert-butyl-2-hydroxyanilino)-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-tert-butyl-2-hydroxyphenyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(5-tert-butyl-2-hydroxy-phenyl)thiocarbamoylamino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(C)(C)C)O)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(C)(C)C)O)C(=O)OC

InChI

InChI=1S/C19H24N2O3S2/c1-6-12-10-13(17(23)24-5)16(26-12)21-18(25)20-14-9-11(19(2,3)4)7-8-15(14)22/h7-10,22H,6H2,1-5H3,(H2,20,21,25)