ethyl 4-methyl-2-[(2-oxidanylidenechromen-3-yl)carbonylcarbamothioylamino]-5-propanoyloxy-thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(2-oxidanylidenechromen-3-yl)carbonylcarbamothioylamino]-5-propanoyloxy-thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(2-oxochromene-3-carbonyl)carbamothioylamino]-5-propanoyloxy-thiophene-3-carboxylate CAS Name: 4-methyl-2-[[[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-sulfanylidenemethyl]amino]-5-(1-oxopropoxy)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(2-oxochromene-3-carbonyl)carbamothioylamino]-5-propanoyloxythiophene-3-carboxylate Traditional Name: 2-[(2-ketochromene-3-carbonyl)thiocarbamoylamino]-4-methyl-5-propionyloxy-thiophene-3-carboxylic acid ethyl ester Formula: C22H20N2O7S2 MolecularWeight: 488.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C(=C(S1)NC(=S)NC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OCC)C

Isomeric SMILES

CCC(=O)OC1=C(C(=C(S1)NC(=S)NC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OCC)C

InChI

InChI=1S/C22H20N2O7S2/c1-4-15(25)31-21-11(3)16(20(28)29-5-2)18(33-21)24-22(32)23-17(26)13-10-12-8-6-7-9-14(12)30-19(13)27/h6-10H,4-5H2,1-3H3,(H2,23,24,26,32)