[2-oxidanylidene-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] 3-(furan-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] 3-(furan-2-yl)propanoate Openeye Name: [2-oxo-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] 3-(2-furyl)propanoate CAS Name: 3-(2-furanyl)propanoic acid [2-oxo-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] ester IUPAC Name: [2-oxo-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] 3-(furan-2-yl)propanoate Traditional Name: 3-(2-furyl)propionic acid [2-keto-2-[(3S)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]ethyl] ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2S1)C(=O)COC(=O)CCC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](N(C2=CC=CC=C2S1)C(=O)COC(=O)CCC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C23H21NO4S/c25-22(15-28-23(26)13-12-18-9-6-14-27-18)24-19-10-4-5-11-21(19)29-16-20(24)17-7-2-1-3-8-17/h1-11,14,20H,12-13,15-16H2/t20-/m1/s1