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

Systemtic Name: ethyl 2-(morpholin-4-ylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(morpholinocarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(4-morpholinylamino)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(morpholin-4-ylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(morpholinothiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S2/c1-2-24-17(22)14-12-15(13-6-4-3-5-7-13)26-16(14)19-18(25)20-21-8-10-23-11-9-21/h3-7,12H,2,8-11H2,1H3,(H2,19,20,25)