ethyl 5-phenyl-2-(thiomorpholin-4-ylcarbothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-(thiomorpholin-4-ylcarbothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-(thiomorpholine-4-carbothioylamino)thiophene-3-carboxylate CAS Name: 5-phenyl-2-[[sulfanylidene(thiomorpholin-4-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-(thiomorpholine-4-carbothioylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-(thiomorpholine-4-carbothioylamino)thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O2S3 MolecularWeight: 392.5586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCSCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCSCC3

InChI

InChI=1S/C18H20N2O2S3/c1-2-22-17(21)14-12-15(13-6-4-3-5-7-13)25-16(14)19-18(23)20-8-10-24-11-9-20/h3-7,12H,2,8-11H2,1H3,(H,19,23)