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

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-benzamide Openeye Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxy-benzamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-pentoxybenzamide IUPAC Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-pentoxybenzamide Traditional Name: 3-amoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC

InChI

InChI=1S/C20H22N2O2S2/c1-3-4-5-11-24-15-8-6-7-14(12-15)19(23)22-20-21-17-10-9-16(25-2)13-18(17)26-20/h6-10,12-13H,3-5,11H2,1-2H3,(H,21,22,23)