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

Systemtic Name: 3-butyl-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-butyl-N-phenyl-thiazol-2-imine CAS Name: 3-butyl-N-phenyl-4-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2-thiazolimine IUPAC Name: 4-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-3-butyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(4-benzylpiperidino)sulfonylphenyl]-3-butyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C31H35N3O2S2 MolecularWeight: 545.7585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H35N3O2S2/c1-2-3-20-34-30(24-37-31(34)32-28-12-8-5-9-13-28)27-14-16-29(17-15-27)38(35,36)33-21-18-26(19-22-33)23-25-10-6-4-7-11-25/h4-17,24,26H,2-3,18-23H2,1H3