2-[4-(5-chloranyl-3-methyl-2-oxidanylidene-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)piperidin-1-yl]ethanal

Systemtic Name: 2-[4-(5-chloranyl-3-methyl-2-oxidanylidene-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)piperidin-1-yl]ethanal Openeye Name: 2-[4-(5-chloro-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)-1-piperidyl]acetaldehyde CAS Name: 2-[4-(5-chloro-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)-1-piperidinyl]acetaldehyde IUPAC Name: 2-[4-(5-chloro-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)piperidin-1-yl]acetaldehyde Traditional Name: 2-[4-(5-chloro-2-keto-3-methyl-1,3-benzothiazol-4-yl)-2-(4-fluorophenyl)piperidino]acetaldehyde Formula: C21H20ClFN2O2S MolecularWeight: 418.912103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2C3CCN(C(C3)C4=CC=C(C=C4)F)CC=O)Cl)SC1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2C3CCN(C(C3)C4=CC=C(C=C4)F)CC=O)Cl)SC1=O

InChI

InChI=1S/C21H20ClFN2O2S/c1-24-20-18(28-21(24)27)7-6-16(22)19(20)14-8-9-25(10-11-26)17(12-14)13-2-4-15(23)5-3-13/h2-7,11,14,17H,8-10,12H2,1H3