(2S)-2-[2-[(2S)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-[(2S)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-[(2S)-6-chloro-3-keto-4H-1,4-benzothiazin-2-yl]acetyl]amino]-N-ethyl-propionamide Formula: C15H18ClN3O3S MolecularWeight: 355.83972

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CC1C(=O)NC2=C(S1)C=CC(=C2)Cl

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)C[C@H]1C(=O)NC2=C(S1)C=CC(=C2)Cl

InChI

InChI=1S/C15H18ClN3O3S/c1-3-17-14(21)8(2)18-13(20)7-12-15(22)19-10-6-9(16)4-5-11(10)23-12/h4-6,8,12H,3,7H2,1-2H3,(H,17,21)(H,18,20)(H,19,22)/t8-,12-/m0/s1