ethyl 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylcarbamothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylcarbamothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[[2-(3-methyl-4-propan-2-ylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]carbamothioylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]thiocarbamoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=S)NC(=O)COC3=CC(=C(C=C3)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=S)NC(=O)COC3=CC(=C(C=C3)C(C)C)C

InChI

InChI=1S/C26H28N2O4S2/c1-5-31-25(30)23-21(18-9-7-6-8-10-18)15-34-24(23)28-26(33)27-22(29)14-32-19-11-12-20(16(2)3)17(4)13-19/h6-13,15-16H,5,14H2,1-4H3,(H2,27,28,29,33)