2-(4H-3,1-benzothiazin-2-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC=CC=C3CS2

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC=CC=C3CS2

InChI

InChI=1S/C17H18N2OS2/c1-11-8-14(12(2)19(11)3)16(20)10-22-17-18-15-7-5-4-6-13(15)9-21-17/h4-8H,9-10H2,1-3H3