N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-imidazolyl)-4-pyrimidinyl]-2-morpholinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide Traditional Name: 4-(2-imidazol-1-ylpyrimidin-4-yl)-N-piperonyl-morpholine-2-carboxamide Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C2=NC(=NC=C2)N3C=CN=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COC(CN1C2=NC(=NC=C2)N3C=CN=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H20N6O4/c27-19(23-10-14-1-2-15-16(9-14)30-13-29-15)17-11-25(7-8-28-17)18-3-4-22-20(24-18)26-6-5-21-12-26/h1-6,9,12,17H,7-8,10-11,13H2,(H,23,27)