ethyl 5-methyl-2-(morpholin-4-ylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-(morpholin-4-ylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-2-(morpholinocarbamothioylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(4-morpholinylamino)-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-(morpholin-4-ylcarbamothioylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-(morpholinothiocarbamoylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NN3CCOCC3

InChI

InChI=1S/C19H23N3O3S2/c1-3-25-18(23)16-15(14-7-5-4-6-8-14)13(2)27-17(16)20-19(26)21-22-9-11-24-12-10-22/h4-8H,3,9-12H2,1-2H3,(H2,20,21,26)