(2S,6S)-2,6-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)morpholine-4-carbothioamide

Systemtic Name: (2S,6S)-2,6-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)morpholine-4-carbothioamide Openeye Name: (2S,6S)-2,6-dimethyl-N-(4-morpholinosulfonylphenyl)morpholine-4-carbothioamide CAS Name: (2S,6S)-2,6-dimethyl-N-[4-(4-morpholinylsulfonyl)phenyl]-4-morpholinecarbothioamide IUPAC Name: (2S,6S)-2,6-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)morpholine-4-carbothioamide Traditional Name: (2S,6S)-2,6-dimethyl-N-(4-morpholinosulfonylphenyl)morpholine-4-carbothioamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H25N3O4S2/c1-13-11-19(12-14(2)24-13)17(25)18-15-3-5-16(6-4-15)26(21,22)20-7-9-23-10-8-20/h3-6,13-14H,7-12H2,1-2H3,(H,18,25)/t13-,14-/m0/s1