(3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C24H24N4O3S MolecularWeight: 448.53736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)[C@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C24H24N4O3S/c1-2-17-8-9-18-22(14-17)32-24(26-18)28(12-5-11-27-13-10-25-16-27)23(29)21-15-30-19-6-3-4-7-20(19)31-21/h3-4,6-10,13-14,16,21H,2,5,11-12,15H2,1H3/t21-/m1/s1