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

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[2-(1-imidazolyl)-4-pyrimidinyl]-2-morpholinecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-ylpyrimidin-4-yl)morpholine-2-carboxamide Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CN(CCO3)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CN(CCO3)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C21H22N6O4/c1-14(15-2-3-16-17(10-15)31-13-30-16)24-20(28)18-11-26(8-9-29-18)19-4-5-23-21(25-19)27-7-6-22-12-27/h2-7,10,12,14,18H,8-9,11,13H2,1H3,(H,24,28)