2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide Formula: C21H17FN2OS3 MolecularWeight: 428.565883

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N=C(S1)SCC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1C2=CC=CC=C2N=C(S1)SCC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C21H17FN2OS3/c22-16-9-7-14(8-10-16)20(18-6-3-11-26-18)24-19(25)13-28-21-23-17-5-2-1-4-15(17)12-27-21/h1-11,20H,12-13H2,(H,24,25)