[2-oxidanylidene-2-(pentylamino)ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 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 [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 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 [2-(amylamino)-2-keto-ethyl] ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)CC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CCCCCNC(=O)COC(=O)C[C@H]1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C17H22N2O4S/c1-2-3-6-9-18-15(20)11-23-16(21)10-14-17(22)19-12-7-4-5-8-13(12)24-14/h4-5,7-8,14H,2-3,6,9-11H2,1H3,(H,18,20)(H,19,22)/t14-/m0/s1