[(2R)-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [(1R)-1-(phenethylcarbamoyl)propyl] 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid [(2R)-1-oxo-1-(phenethylamino)butan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(phenethylamino)butan-2-yl] 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid [(1R)-1-(phenethylcarbamoyl)propyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC1=CC=CC=C1)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC[C@H](C(=O)NCCC1=CC=CC=C1)OC(=O)C[C@H]2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C22H24N2O4S/c1-2-17(21(26)23-13-12-15-8-4-3-5-9-15)28-20(25)14-19-22(27)24-16-10-6-7-11-18(16)29-19/h3-11,17,19H,2,12-14H2,1H3,(H,23,26)(H,24,27)/t17-,19+/m1/s1