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

Systemtic Name: 2-methyl-N-[[2-oxidanylidene-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]propanethioamide Openeye Name: 2-methyl-N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]propanethioamide CAS Name: 2-methyl-N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-5-oxazolidinyl]methyl]propanethioamide IUPAC Name: 2-methyl-N-[[2-oxo-3-[4-(1,4-thiazepan-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]propanethioamide Traditional Name: N-[[2-keto-3-[4-(1,4-thiazepan-4-yl)phenyl]oxazolidin-5-yl]methyl]-2-methyl-thiopropionamide Formula: C19H27N3O2S2 MolecularWeight: 393.56658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O2S2/c1-14(2)18(25)20-12-17-13-22(19(23)24-17)16-6-4-15(5-7-16)21-8-3-10-26-11-9-21/h4-7,14,17H,3,8-13H2,1-2H3,(H,20,25)