2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[2-(2-thienyl)ethyl]benzamide CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-[2-(2-thienyl)ethyl]benzamide Formula: C21H18N2OS3 MolecularWeight: 410.57542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3S2)C(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3S2)C(=O)NCCC4=CC=CS4

InChI

InChI=1S/C21H18N2OS3/c24-20(22-12-11-16-7-5-13-25-16)17-8-2-1-6-15(17)14-26-21-23-18-9-3-4-10-19(18)27-21/h1-10,13H,11-12,14H2,(H,22,24)