N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-5-yl-benzamide

Systemtic Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-5-yl-benzamide Openeye Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-5-yl-benzamide CAS Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-(5-pyrimidinyl)benzamide IUPAC Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-5-ylbenzamide Traditional Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-(5-pyrimidyl)benzamide Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CN=CN=C5

Isomeric SMILES

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CN=CN=C5

InChI

InChI=1S/C25H26N4O/c30-25(20-6-4-18(5-7-20)22-15-26-17-27-16-22)28-23-9-8-19-10-12-29(24-2-1-3-24)13-11-21(19)14-23/h4-9,14-17,24H,1-3,10-13H2,(H,28,30)