2-[3-(phenylmethylsulfanyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[3-(phenylmethylsulfanyl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-(3-benzylsulfanylpropanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-3-(phenylmethylthio)propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-(3-benzylsulfanylpropanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[3-(benzylthio)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C18H20N2O2S2 MolecularWeight: 360.4936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)CCSCC3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)CCSCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S2/c19-17(22)16-13-7-4-8-14(13)24-18(16)20-15(21)9-10-23-11-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H2,19,22)(H,20,21)