(2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide

Systemtic Name: (2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide Openeye Name: (2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide CAS Name: (2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide IUPAC Name: (2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide Traditional Name: (2S,7R)-2-ethyl-7-methyl-N-phenyl-1,4-oxazepane-4-carbothioamide Formula: C15H22N2OS MolecularWeight: 278.41298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC(O1)C)C(=S)NC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2OS/c1-3-14-11-17(10-9-12(2)18-14)15(19)16-13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3,(H,16,19)/t12-,14+/m1/s1