methyl 5-oxidanylidene-5-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]pentanoate Openeye Name: methyl 5-oxo-5-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]pentanoate CAS Name: 5-oxo-5-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethylamino]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethylamino]pentanoate Traditional Name: 5-keto-5-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethylamino]valeric acid methyl ester Formula: C16H20N2O4S2 MolecularWeight: 368.471

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NCCSC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

COC(=O)CCCC(=O)NCCSC1C(=O)NC2=CC=CC=C2S1

InChI

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