4-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-methyl-N-phenyl-1,3-thiazol-2-imine hydrochloride

Systemtic Name: 4-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-methyl-N-phenyl-1,3-thiazol-2-imine hydrochloride Openeye Name: 4-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-3-methyl-N-phenyl-thiazol-2-imine hydrochloride CAS Name: 4-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-3-methyl-N-phenyl-2-thiazolimine hydrochloride IUPAC Name: 4-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-3-methyl-N-phenyl-1,3-thiazol-2-imine hydrochloride Traditional Name: [4-(4-chloro-3-piperidinosulfonyl-phenyl)-3-methyl-4-thiazolin-2-ylidene]-phenyl-amine hydrochloride Formula: C21H23Cl2N3O2S2 MolecularWeight: 484.46222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4.Cl

Isomeric SMILES

CN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4.Cl

InChI

InChI=1S/C21H22ClN3O2S2.ClH/c1-24-19(15-28-21(24)23-17-8-4-2-5-9-17)16-10-11-18(22)20(14-16)29(26,27)25-12-6-3-7-13-25;/h2,4-5,8-11,14-15H,3,6-7,12-13H2,1H3;1H