6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H17N3O2S2/c24-18-11-26-16-8-7-12(10-14(16)21-18)20(25)23-9-3-5-15(23)19-22-13-4-1-2-6-17(13)27-19/h1-2,4,6-8,10,15H,3,5,9,11H2,(H,21,24)/t15-/m0/s1