N-[1-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylcarbonyl)phenyl]pyrazol-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylcarbonyl)phenyl]pyrazol-4-yl]pyridine-3-carboxamide Openeye Name: N-[1-[4-(3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl)phenyl]pyrazol-4-yl]pyridine-3-carboxamide CAS Name: N-[1-[4-[3,5-dihydro-2H-1,4-benzoxazepin-4-yl(oxo)methyl]phenyl]-4-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: N-[1-[4-(3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl)phenyl]pyrazol-4-yl]pyridine-3-carboxamide Traditional Name: N-[1-[4-(3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl)phenyl]pyrazol-4-yl]nicotinamide Formula: C25H21N5O3 MolecularWeight: 439.46594

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2CN1C(=O)C3=CC=C(C=C3)N4C=C(C=N4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1COC2=CC=CC=C2CN1C(=O)C3=CC=C(C=C3)N4C=C(C=N4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C25H21N5O3/c31-24(19-5-3-11-26-14-19)28-21-15-27-30(17-21)22-9-7-18(8-10-22)25(32)29-12-13-33-23-6-2-1-4-20(23)16-29/h1-11,14-15,17H,12-13,16H2,(H,28,31)