N-phenyl-4-(3-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine

Systemtic Name: N-phenyl-4-(3-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine Openeye Name: N-phenyl-4-[3-(1-piperidylsulfonyl)phenyl]-3-(3-pyridylmethyl)thiazol-2-imine CAS Name: N-phenyl-4-[3-(1-piperidinylsulfonyl)phenyl]-3-(3-pyridinylmethyl)-2-thiazolimine IUPAC Name: N-phenyl-4-(3-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine Traditional Name: phenyl-[4-(3-piperidinosulfonylphenyl)-3-(3-pyridylmethyl)-4-thiazolin-2-ylidene]amine Formula: C26H26N4O2S2 MolecularWeight: 490.64024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CSC(=NC4=CC=CC=C4)N3CC5=CN=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CSC(=NC4=CC=CC=C4)N3CC5=CN=CC=C5

InChI

InChI=1S/C26H26N4O2S2/c31-34(32,29-15-5-2-6-16-29)24-13-7-10-22(17-24)25-20-33-26(28-23-11-3-1-4-12-23)30(25)19-21-9-8-14-27-18-21/h1,3-4,7-14,17-18,20H,2,5-6,15-16,19H2