2-methylsulfanyl-4-(2-morpholin-4-ylethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-(2-morpholin-4-ylethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 2-methylsulfanyl-4-(2-morpholinoethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile CAS Name: 2-(methylthio)-4-[2-(4-morpholinyl)ethoxy]-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-(2-morpholin-4-ylethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-(2-morpholinoethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)OCCN2CCOCC2)C#N)N3CCC4=CC=CC=C4CC3

Isomeric SMILES

CSC1=NC(=C(C(=N1)OCCN2CCOCC2)C#N)N3CCC4=CC=CC=C4CC3

InChI

InChI=1S/C22H27N5O2S/c1-30-22-24-20(27-8-6-17-4-2-3-5-18(17)7-9-27)19(16-23)21(25-22)29-15-12-26-10-13-28-14-11-26/h2-5H,6-15H2,1H3