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

Systemtic Name: N-[5-ethyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[5-ethyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[5-ethyl-3-[(4-methyl-1-piperazinyl)-[4-(methylthio)phenyl]methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[5-ethyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-ethyl-3-[(4-methylpiperazino)-[4-(methylthio)phenyl]methyl]-2-thienyl]-2-furamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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)C

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2S2/c1-4-18-16-20(24(31-18)25-23(28)21-6-5-15-29-21)22(27-13-11-26(2)12-14-27)17-7-9-19(30-3)10-8-17/h5-10,15-16,22H,4,11-14H2,1-3H3,(H,25,28)