2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(6-methoxypyridin-3-yl)methyl]benzamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(6-methoxypyridin-3-yl)methyl]benzamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(6-methoxy-3-pyridyl)methyl]benzamide CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(6-methoxy-3-pyridinyl)methyl]benzamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(6-methoxypyridin-3-yl)methyl]benzamide Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(6-methoxy-3-pyridyl)methyl]benzamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)CNC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=NC=C(C=C1)CNC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19N3O2S2/c1-27-20-11-10-15(12-23-20)13-24-21(26)17-7-3-2-6-16(17)14-28-22-25-18-8-4-5-9-19(18)29-22/h2-12H,13-14H2,1H3,(H,24,26)