2-azanyl-4-prop-2-enoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-prop-2-enoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 4-allyloxy-2-amino-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-prop-2-enoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-prop-2-enoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 4-allyloxy-2-amino-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O/c1-2-11-24-17-15(12-19)16(21-18(20)22-17)23-9-7-13-5-3-4-6-14(13)8-10-23/h2-6H,1,7-11H2,(H2,20,21,22)