2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]pyrimidine-5-carboxamide

Systemtic Name: 2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]pyrimidine-5-carboxamide Openeye Name: 2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]pyrimidine-5-carboxamide CAS Name: 2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]-5-pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]pyrimidine-5-carboxamide Traditional Name: 2-tert-butyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)butyl]pyrimidine-5-carboxamide Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CN=C(N=C3)C(C)(C)C

Isomeric SMILES

CCCC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CN=C(N=C3)C(C)(C)C

InChI

InChI=1S/C21H27N3O3/c1-5-6-16(14-7-8-17-18(11-14)27-10-9-26-17)24-19(25)15-12-22-20(23-13-15)21(2,3)4/h7-8,11-13,16H,5-6,9-10H2,1-4H3,(H,24,25)