2-[ethyl(prop-2-enyl)amino]-6-oxidanylidene-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-[ethyl(prop-2-enyl)amino]-6-oxidanylidene-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Openeye Name: 1-allyl-2-[allyl(ethyl)amino]-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile CAS Name: 2-[ethyl(prop-2-enyl)amino]-6-oxo-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-5-pyrimidinecarbonitrile IUPAC Name: 2-[ethyl(prop-2-enyl)amino]-6-oxo-1-prop-2-enyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Traditional Name: 1-allyl-2-[allyl(ethyl)amino]-6-keto-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=C)C1=NC(=C(C(=O)N1CC=C)C#N)N2CCC3=CC=CC=C3CC2

Isomeric SMILES

CCN(CC=C)C1=NC(=C(C(=O)N1CC=C)C#N)N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C23H27N5O/c1-4-13-26(6-3)23-25-21(20(17-24)22(29)28(23)14-5-2)27-15-11-18-9-7-8-10-19(18)12-16-27/h4-5,7-10H,1-2,6,11-16H2,3H3