3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-thiophen-2-yl-piperidin-4-yl]methyl]-1-methyl-1-propyl-guanidine

Systemtic Name: 3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-thiophen-2-yl-piperidin-4-yl]methyl]-1-methyl-1-propyl-guanidine Openeye Name: 3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-(2-thienyl)-4-piperidyl]methyl]-1-methyl-1-propyl-guanidine CAS Name: 3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-thiophen-2-yl-4-piperidinyl]methyl]-1-methyl-1-propylguanidine IUPAC Name: 3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-thiophen-2-ylpiperidin-4-yl]methyl]-1-methyl-1-propylguanidine Traditional Name: 3-cyano-2-[[1-(4-fluorophenyl)sulfonyl-4-(2-thienyl)-4-piperidyl]methyl]-1-methyl-1-propyl-guanidine Formula: C22H28FN5O2S2 MolecularWeight: 477.618423

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(=NCC1(CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CS3)NC#N

Isomeric SMILES

CCCN(C)C(=NCC1(CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CS3)NC#N

InChI

InChI=1S/C22H28FN5O2S2/c1-3-12-27(2)21(26-17-24)25-16-22(20-5-4-15-31-20)10-13-28(14-11-22)32(29,30)19-8-6-18(23)7-9-19/h4-9,15H,3,10-14,16H2,1-2H3,(H,25,26)