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

Systemtic Name: 6-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[(2S)-2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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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=C5N4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C20H18N4O2S/c25-18-11-27-17-8-7-12(10-15(17)21-18)20(26)24-9-3-6-16(24)19-22-13-4-1-2-5-14(13)23-19/h1-2,4-5,7-8,10,16H,3,6,9,11H2,(H,21,25)(H,22,23)/t16-/m0/s1