N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[4-(1H-indol-3-yl)thiazol-2-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[4-(1H-indol-3-yl)-2-thiazolyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: N-[4-(1H-indol-3-yl)thiazol-2-yl]-3-(3-keto-1,4-benzothiazin-4-yl)propionamide Formula: C22H18N4O2S2 MolecularWeight: 434.53392

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)NC3=NC(=CS3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)NC3=NC(=CS3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H18N4O2S2/c27-20(9-10-26-18-7-3-4-8-19(18)29-13-21(26)28)25-22-24-17(12-30-22)15-11-23-16-6-2-1-5-14(15)16/h1-8,11-12,23H,9-10,13H2,(H,24,25,27)