(3S)-3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide

Systemtic Name: (3S)-3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Openeye Name: (3S)-3-methyl-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide CAS Name: (3S)-3-methyl-N-[4-(4-morpholinylsulfonyl)phenyl]-1-piperidinecarbothioamide IUPAC Name: (3S)-3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Traditional Name: (3S)-3-methyl-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O3S2/c1-14-3-2-8-19(13-14)17(24)18-15-4-6-16(7-5-15)25(21,22)20-9-11-23-12-10-20/h4-7,14H,2-3,8-13H2,1H3,(H,18,24)/t14-/m0/s1