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

Systemtic Name: methyl 2-(morpholin-4-ylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(morpholinocarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(4-morpholinylamino)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(morpholin-4-ylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(morpholinothiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C17H19N3O3S2 MolecularWeight: 377.48106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S2/c1-22-16(21)13-11-14(12-5-3-2-4-6-12)25-15(13)18-17(24)19-20-7-9-23-10-8-20/h2-6,11H,7-10H2,1H3,(H2,18,19,24)