3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)pyrimidin-2-yl]benzamide

Systemtic Name: 3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)pyrimidin-2-yl]benzamide Openeye Name: 3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)pyrimidin-2-yl]benzamide CAS Name: 3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-2-pyrimidinyl]benzamide IUPAC Name: 3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)pyrimidin-2-yl]benzamide Traditional Name: 3-cyano-N-[4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)pyrimidin-2-yl]benzamide Formula: C23H21N5O2 MolecularWeight: 399.44514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCCC2)C3=NC(=NC=C3)NC(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCCC2)C3=NC(=NC=C3)NC(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H21N5O2/c1-30-19-8-9-20-17(14-19)6-2-3-12-28(20)21-10-11-25-23(26-21)27-22(29)18-7-4-5-16(13-18)15-24/h4-5,7-11,13-14H,2-3,6,12H2,1H3,(H,25,26,27,29)