(3R)-N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H20BrN3O3S/c1-23(2)9-10-24(20-22-14-8-7-13(21)11-18(14)28-20)19(25)17-12-26-15-5-3-4-6-16(15)27-17/h3-8,11,17H,9-10,12H2,1-2H3/t17-/m1/s1