3-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-(4H-3,1-benzothiazin-2-ylthio)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(4H-3,1-benzothiazin-2-ylthio)acetyl]amino]-N,N-diethyl-benzamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3CS2

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3CS2

InChI

InChI=1S/C21H23N3O2S2/c1-3-24(4-2)20(26)15-9-7-10-17(12-15)22-19(25)14-28-21-23-18-11-6-5-8-16(18)13-27-21/h5-12H,3-4,13-14H2,1-2H3,(H,22,25)