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

Systemtic Name: 3-pentyl-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-pentyl-N-phenyl-thiazol-2-imine CAS Name: 3-pentyl-N-phenyl-4-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2-thiazolimine IUPAC Name: 4-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-3-pentyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [3-amyl-4-[4-(4-benzylpiperidino)sulfonylphenyl]-4-thiazolin-2-ylidene]-phenyl-amine Formula: C32H37N3O2S2 MolecularWeight: 559.78508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C32H37N3O2S2/c1-2-3-10-21-35-31(25-38-32(35)33-29-13-8-5-9-14-29)28-15-17-30(18-16-28)39(36,37)34-22-19-27(20-23-34)24-26-11-6-4-7-12-26/h4-9,11-18,25,27H,2-3,10,19-24H2,1H3