ethyl 4-oxidanylidene-4-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]butanoate Openeye Name: ethyl 4-oxo-4-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]butanoate CAS Name: 4-oxo-4-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethylamino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]butanoate Traditional Name: 4-keto-4-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethylamino]butyric acid ethyl ester Formula: C16H20N2O4S2 MolecularWeight: 368.471

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NCCSC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)CCC(=O)NCCSC1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C16H20N2O4S2/c1-2-22-14(20)8-7-13(19)17-9-10-23-16-15(21)18-11-5-3-4-6-12(11)24-16/h3-6,16H,2,7-10H2,1H3,(H,17,19)(H,18,21)