(3S,5S)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3,5-dimethyl-piperidine-1-carbothioamide

Systemtic Name: (3S,5S)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3,5-dimethyl-piperidine-1-carbothioamide Openeye Name: (3S,5S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-3,5-dimethyl-piperidine-1-carbothioamide CAS Name: (3S,5S)-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3,5-dimethyl-1-piperidinecarbothioamide IUPAC Name: (3S,5S)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3,5-dimethylpiperidine-1-carbothioamide Traditional Name: (3S,5S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-3,5-dimethyl-piperidine-1-carbothioamide Formula: C18H26ClN3O3S2 MolecularWeight: 432.00034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl)C

InChI

InChI=1S/C18H26ClN3O3S2/c1-13-9-14(2)12-21(11-13)18(26)20-17-10-15(3-4-16(17)19)27(23,24)22-5-7-25-8-6-22/h3-4,10,13-14H,5-9,11-12H2,1-2H3,(H,20,26)/t13-,14-/m0/s1