6-tert-butyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Systemtic Name: 6-tert-butyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide Openeye Name: 6-tert-butyl-N-[4-(4-pyridyl)thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide CAS Name: 6-tert-butyl-N-(4-pyridin-4-yl-2-thiazolyl)-2,3-dihydro-1,4-benzodioxin-2-carboxamide IUPAC Name: 6-tert-butyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide Traditional Name: 6-tert-butyl-N-[4-(4-pyridyl)thiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-2-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(CO2)C(=O)NC3=NC(=CS3)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(CO2)C(=O)NC3=NC(=CS3)C4=CC=NC=C4

InChI

InChI=1S/C21H21N3O3S/c1-21(2,3)14-4-5-16-17(10-14)26-11-18(27-16)19(25)24-20-23-15(12-28-20)13-6-8-22-9-7-13/h4-10,12,18H,11H2,1-3H3,(H,23,24,25)