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

Systemtic Name: [(1S)-2-oxidanylidene-2-(phenethylamino)-1-pyridin-3-yl-ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [(1S)-2-oxo-2-(phenethylamino)-1-(3-pyridyl)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 [(1S)-2-oxo-2-(phenethylamino)-1-(3-pyridinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-2-(phenethylamino)-1-pyridin-3-ylethyl] 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 [(1S)-2-keto-2-(phenethylamino)-1-(3-pyridyl)ethyl] ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(C2=CN=CC=C2)OC(=O)CC3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)[C@H](C2=CN=CC=C2)OC(=O)C[C@H]3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23N3O4S/c29-22(15-21-24(30)28-19-10-4-5-11-20(19)33-21)32-23(18-9-6-13-26-16-18)25(31)27-14-12-17-7-2-1-3-8-17/h1-11,13,16,21,23H,12,14-15H2,(H,27,31)(H,28,30)/t21-,23-/m0/s1