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

Systemtic Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-4-yl-benzamide Openeye Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-4-yl-benzamide CAS Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-(4-pyrimidinyl)benzamide IUPAC Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-pyrimidin-4-ylbenzamide Traditional Name: N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-(4-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=NC=NC=C5

Isomeric SMILES

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

InChI

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