4-oxidanylidene-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-oxidanylidene-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile Openeye Name: 4-oxo-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile CAS Name: 4-oxo-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 4-oxo-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-2-(3-phenoxypropylamino)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidine-5-carbonitrile Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=CC=CC=C21)C3=C(C(=O)N=C(N3)NCCCOC4=CC=CC=C4)C#N

Isomeric SMILES

C1CN(CCC2=CC=CC=C21)C3=C(C(=O)N=C(N3)NCCCOC4=CC=CC=C4)C#N

InChI

InChI=1S/C24H25N5O2/c25-17-21-22(29-14-11-18-7-4-5-8-19(18)12-15-29)27-24(28-23(21)30)26-13-6-16-31-20-9-2-1-3-10-20/h1-5,7-10H,6,11-16H2,(H2,26,27,28,30)