3-phenethyl-N-phenyl-4-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-1,3-thiazol-2-imine

Systemtic Name: 3-phenethyl-N-phenyl-4-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-1,3-thiazol-2-imine Openeye Name: 4-[4-[(4-benzyl-1-piperidyl)sulfonyl]phenyl]-3-phenethyl-N-phenyl-thiazol-2-imine CAS Name: 3-phenethyl-N-phenyl-4-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2-thiazolimine IUPAC Name: 4-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-3-phenethyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(4-benzylpiperidino)sulfonylphenyl]-3-phenethyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C35H35N3O2S2 MolecularWeight: 593.8013

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C4=CSC(=NC5=CC=CC=C5)N4CCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C4=CSC(=NC5=CC=CC=C5)N4CCC6=CC=CC=C6

InChI

InChI=1S/C35H35N3O2S2/c39-42(40,37-23-20-30(21-24-37)26-29-12-6-2-7-13-29)33-18-16-31(17-19-33)34-27-41-35(36-32-14-8-3-9-15-32)38(34)25-22-28-10-4-1-5-11-28/h1-19,27,30H,20-26H2