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

Systemtic Name: 3-hexyl-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-hexyl-N-phenyl-thiazol-2-imine CAS Name: 3-hexyl-N-phenyl-4-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2-thiazolimine IUPAC Name: 4-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-3-hexyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(4-benzylpiperidino)sulfonylphenyl]-3-hexyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C33H39N3O2S2 MolecularWeight: 573.81166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C33H39N3O2S2/c1-2-3-4-11-22-36-32(26-39-33(36)34-30-14-9-6-10-15-30)29-16-18-31(19-17-29)40(37,38)35-23-20-28(21-24-35)25-27-12-7-5-8-13-27/h5-10,12-19,26,28H,2-4,11,20-25H2,1H3