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

Systemtic Name: 1-ethyl-2-(2-methylsulfanylethyl)-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 1-ethyl-2-(2-methylsulfanylethyl)-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile CAS Name: 1-ethyl-2-[2-(methylthio)ethyl]-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 1-ethyl-2-(2-methylsulfanylethyl)-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 1-ethyl-6-keto-2-[2-(methylthio)ethyl]-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C(C1=O)C#N)N2CCC3=CC=CC=C3CC2)CCSC

Isomeric SMILES

CCN1C(=NC(=C(C1=O)C#N)N2CCC3=CC=CC=C3CC2)CCSC

InChI

InChI=1S/C20H24N4OS/c1-3-24-18(10-13-26-2)22-19(17(14-21)20(24)25)23-11-8-15-6-4-5-7-16(15)9-12-23/h4-7H,3,8-13H2,1-2H3