N-[5-ethyl-3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[5-ethyl-3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[5-ethyl-3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[5-ethyl-3-[(4-ethyl-1-piperazinyl)-[4-(methylthio)phenyl]methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[5-ethyl-3-[(4-ethylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-ethyl-3-[(4-ethylpiperazino)-[4-(methylthio)phenyl]methyl]-2-thienyl]-2-furamide Formula: C25H31N3O2S2 MolecularWeight: 469.66254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC=C(C=C3)SC)N4CCN(CC4)CC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC=C(C=C3)SC)N4CCN(CC4)CC

InChI

InChI=1S/C25H31N3O2S2/c1-4-19-17-21(25(32-19)26-24(29)22-7-6-16-30-22)23(18-8-10-20(31-3)11-9-18)28-14-12-27(5-2)13-15-28/h6-11,16-17,23H,4-5,12-15H2,1-3H3,(H,26,29)