N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-pentoxy-benzamide

Systemtic Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-pentoxy-benzamide Openeye Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-pentoxy-benzamide CAS Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-pentoxybenzamide IUPAC Name: N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-3-pentoxybenzamide Traditional Name: 3-amoxy-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C)OC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C)OC

InChI

InChI=1S/C21H24N2O3S/c1-4-5-6-12-26-16-9-7-8-15(13-16)20(24)23-21-22-18-17(25-3)11-10-14(2)19(18)27-21/h7-11,13H,4-6,12H2,1-3H3,(H,22,23,24)