(2S)-N-[2-(1-adamantyl)ethyl]-2-methyl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: (2S)-N-[2-(1-adamantyl)ethyl]-2-methyl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: (2S)-N-[2-(1-adamantyl)ethyl]-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: (2S)-N-[2-(1-adamantyl)ethyl]-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: (2S)-N-[2-(1-adamantyl)ethyl]-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: (2S)-N-[2-(1-adamantyl)ethyl]-3-keto-2-methyl-4H-1,4-benzothiazine-6-carboxamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H28N2O2S/c1-13-20(25)24-18-9-17(2-3-19(18)27-13)21(26)23-5-4-22-10-14-6-15(11-22)8-16(7-14)12-22/h2-3,9,13-16H,4-8,10-12H2,1H3,(H,23,26)(H,24,25)/t13-,14?,15?,16?,22?/m0/s1