1,6-diethyl-3,5-bis(oxidanyl)-4-piperazin-1-yl-7-(2-thiophen-2-ylethylsulfanyl)naphthalene-2-carboxamide

Systemtic Name: 1,6-diethyl-3,5-bis(oxidanyl)-4-piperazin-1-yl-7-(2-thiophen-2-ylethylsulfanyl)naphthalene-2-carboxamide Openeye Name: 1,6-diethyl-3,5-dihydroxy-4-piperazin-1-yl-7-[2-(2-thienyl)ethylsulfanyl]naphthalene-2-carboxamide CAS Name: 1,6-diethyl-3,5-dihydroxy-4-(1-piperazinyl)-7-(2-thiophen-2-ylethylthio)-2-naphthalenecarboxamide IUPAC Name: 1,6-diethyl-3,5-dihydroxy-4-piperazin-1-yl-7-(2-thiophen-2-ylethylsulfanyl)naphthalene-2-carboxamide Traditional Name: 1,6-diethyl-3,5-dihydroxy-4-piperazino-7-[2-(2-thienyl)ethylthio]-2-naphthamide Formula: C25H31N3O3S2 MolecularWeight: 485.66194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C(C(=C(C=C12)SCCC3=CC=CS3)CC)O)N4CCNCC4)O)C(=O)N

Isomeric SMILES

CCC1=C(C(=C(C2=C(C(=C(C=C12)SCCC3=CC=CS3)CC)O)N4CCNCC4)O)C(=O)N

InChI

InChI=1S/C25H31N3O3S2/c1-3-16-18-14-19(33-13-7-15-6-5-12-32-15)17(4-2)23(29)20(18)22(24(30)21(16)25(26)31)28-10-8-27-9-11-28/h5-6,12,14,27,29-30H,3-4,7-11,13H2,1-2H3,(H2,26,31)