N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(3-keto-4H-1,4-benzothiazin-2-yl)acetamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3O2S2/c1-2-3-6-13-9-10-15-17(11-13)28-21(23-15)24-19(25)12-18-20(26)22-14-7-4-5-8-16(14)27-18/h4-5,7-11,18H,2-3,6,12H2,1H3,(H,22,26)(H,23,24,25)