(2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]propanamide

Systemtic Name: (2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]propanamide Openeye Name: (2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanamide CAS Name: (2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanamide IUPAC Name: (2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanamide Traditional Name: (2S)-N-(4-tert-butylphenyl)-2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]propionamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

C[C@H]([C@@H]1C(=O)NC2=CC=CC=C2S1)C(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H24N2O2S/c1-13(18-20(25)23-16-7-5-6-8-17(16)26-18)19(24)22-15-11-9-14(10-12-15)21(2,3)4/h5-13,18H,1-4H3,(H,22,24)(H,23,25)/t13-,18-/m1/s1