N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methyl-2-imidazolyl)methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[(1-methylimidazol-2-yl)methyl]-N-piperonyl-1,3-benzothiazole-6-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CN1C=CN=C1CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C21H18N4O3S/c1-24-7-6-22-20(24)11-25(10-14-2-5-17-18(8-14)28-13-27-17)21(26)15-3-4-16-19(9-15)29-12-23-16/h2-9,12H,10-11,13H2,1H3