4-ethyl-5-methyl-2-[(2-phenethyloxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4-ethyl-5-methyl-2-[(2-phenethyloxyphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4-ethyl-5-methyl-2-[(2-phenethyloxybenzoyl)carbamothioylamino]thiophene-3-carboxamide CAS Name: 4-ethyl-5-methyl-2-[[[[oxo-(2-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-ethyl-5-methyl-2-[(2-phenethyloxybenzoyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4-ethyl-5-methyl-2-[(2-phenethyloxybenzoyl)thiocarbamoylamino]thiophene-3-carboxamide Formula: C24H25N3O3S2 MolecularWeight: 467.6036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3)C

InChI

InChI=1S/C24H25N3O3S2/c1-3-17-15(2)32-23(20(17)21(25)28)27-24(31)26-22(29)18-11-7-8-12-19(18)30-14-13-16-9-5-4-6-10-16/h4-12H,3,13-14H2,1-2H3,(H2,25,28)(H2,26,27,29,31)