N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-N-[2-(2-thienyl)ethyl]benzamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-pentoxy-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: 3-amoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(2-thienyl)ethyl]benzamide Formula: C26H28N2O2S3 MolecularWeight: 496.70772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)SC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)SC

InChI

InChI=1S/C26H28N2O2S3/c1-3-4-5-15-30-20-9-6-8-19(17-20)25(29)28(14-13-21-10-7-16-32-21)26-27-23-12-11-22(31-2)18-24(23)33-26/h6-12,16-18H,3-5,13-15H2,1-2H3