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

Systemtic Name: N-[3-[(4-ethoxyphenyl)-(4-methylpiperazin-1-yl)methyl]-5-ethyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[(4-ethoxyphenyl)-(4-methylpiperazin-1-yl)methyl]-5-ethyl-2-thienyl]furan-2-carboxamide CAS Name: N-[3-[(4-ethoxyphenyl)-(4-methyl-1-piperazinyl)methyl]-5-ethyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[3-[(4-ethoxyphenyl)-(4-methylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-ethyl-3-[(4-methylpiperazino)-p-phenetyl-methyl]-2-thienyl]-2-furamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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)OCC)N4CCN(CC4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3S/c1-4-20-17-21(25(32-20)26-24(29)22-7-6-16-31-22)23(28-14-12-27(3)13-15-28)18-8-10-19(11-9-18)30-5-2/h6-11,16-17,23H,4-5,12-15H2,1-3H3,(H,26,29)