4-ethoxy-2-[2-(oxan-2-yloxy)ethyl]-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

Systemtic Name: 4-ethoxy-2-[2-(oxan-2-yloxy)ethyl]-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 4-ethoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(2-tetrahydropyran-2-yloxyethyl)pyrimidine-5-carbonitrile CAS Name: 4-ethoxy-2-[2-(2-oxanyloxy)ethyl]-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 4-ethoxy-2-[2-(oxan-2-yloxy)ethyl]-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 4-ethoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(2-tetrahydropyran-2-yloxyethyl)pyrimidine-5-carbonitrile Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1C#N)N2CCC3=CC=CC=C3CC2)CCOC4CCCCO4

Isomeric SMILES

CCOC1=NC(=NC(=C1C#N)N2CCC3=CC=CC=C3CC2)CCOC4CCCCO4

InChI

InChI=1S/C24H30N4O3/c1-2-29-24-20(17-25)23(28-13-10-18-7-3-4-8-19(18)11-14-28)26-21(27-24)12-16-31-22-9-5-6-15-30-22/h3-4,7-8,22H,2,5-6,9-16H2,1H3