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

Systemtic Name: 4-ethyl-5-methyl-2-[[4-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4-ethyl-2-[(4-isobutoxybenzoyl)carbamothioylamino]-5-methyl-thiophene-3-carboxamide CAS Name: 4-ethyl-5-methyl-2-[[[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4-ethyl-5-methyl-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4-ethyl-2-[(4-isobutoxybenzoyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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