N-[[3-[3,3-bis(oxidanylidene)-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide

Systemtic Name: N-[[3-[3,3-bis(oxidanylidene)-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-(3,3-dioxo-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl)-2-oxo-oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[3-(3,3-dioxo-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl)-2-oxo-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[3-(3,3-dioxo-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-(3,3-diketo-1,2,4,5-tetrahydro-3$l^{6}-benzothiepin-7-yl)-2-keto-oxazolidin-5-yl]methyl]thioacetamide Formula: C16H20N2O4S2 MolecularWeight: 368.471

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2=CC3=C(CCS(=O)(=O)CC3)C=C2

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2=CC3=C(CCS(=O)(=O)CC3)C=C2

InChI

InChI=1S/C16H20N2O4S2/c1-11(23)17-9-15-10-18(16(19)22-15)14-3-2-12-4-6-24(20,21)7-5-13(12)8-14/h2-3,8,15H,4-7,9-10H2,1H3,(H,17,23)