N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-4-morpholino-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4-(4-morpholinyl)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-amine IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine Traditional Name: [(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-(4-morpholino-6-pyrrolidino-s-triazin-2-yl)amine Formula: C19H22BrN7O3 MolecularWeight: 476.32708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=N2)NN=CC3=CC4=C(C=C3Br)OCO4)N5CCOCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=N2)N/N=C/C3=CC4=C(C=C3Br)OCO4)N5CCOCC5

InChI

InChI=1S/C19H22BrN7O3/c20-14-10-16-15(29-12-30-16)9-13(14)11-21-25-17-22-18(26-3-1-2-4-26)24-19(23-17)27-5-7-28-8-6-27/h9-11H,1-8,12H2,(H,22,23,24,25)/b21-11+