N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(tetrahydrofuran-2-ylmethylsulfanyl)benzamide CAS Name: N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2-(2-oxolanylmethylthio)benzamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Traditional Name: N-[4-(4-ethylpiperazino)sulfonylphenyl]-2-(tetrahydrofurfurylthio)benzamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4CCCO4

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4CCCO4

InChI

InChI=1S/C24H31N3O4S2/c1-2-26-13-15-27(16-14-26)33(29,30)21-11-9-19(10-12-21)25-24(28)22-7-3-4-8-23(22)32-18-20-6-5-17-31-20/h3-4,7-12,20H,2,5-6,13-18H2,1H3,(H,25,28)