N-[[2-oxidanylidene-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]ethanethioamide

Systemtic Name: N-[[2-oxidanylidene-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[2-keto-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]thioacetamide Formula: C17H23N3O2S2 MolecularWeight: 365.51342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCCSCC3

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCCSCC3

InChI

InChI=1S/C17H23N3O2S2/c1-13(23)18-11-16-12-20(17(21)22-16)15-5-3-14(4-6-15)19-7-2-9-24-10-8-19/h3-6,16H,2,7-12H2,1H3,(H,18,23)