N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-pentoxy-benzamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-pentoxy-benzamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-pentoxy-benzamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-pentoxybenzamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-pentoxybenzamide Traditional Name: 3-amoxy-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C(=C4)C)C

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C(=C4)C)C

InChI

InChI=1S/C26H28N2O3S/c1-4-5-6-12-30-21-10-7-9-20(16-21)25(29)28(17-22-11-8-13-31-22)26-27-23-14-18(2)19(3)15-24(23)32-26/h7-11,13-16H,4-6,12,17H2,1-3H3