2-methoxy-N-[(4S)-5-oxidanylidene-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-4H-pyrazol-3-yl]benzamide

Systemtic Name: 2-methoxy-N-[(4S)-5-oxidanylidene-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-4H-pyrazol-3-yl]benzamide Openeye Name: 2-methoxy-N-[(4S)-5-oxo-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-4H-pyrazol-3-yl]benzamide CAS Name: 2-methoxy-N-[(4S)-5-oxo-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-4H-pyrazol-3-yl]benzamide IUPAC Name: 2-methoxy-N-[(4S)-5-oxo-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-4H-pyrazol-3-yl]benzamide Traditional Name: N-[(4S)-5-keto-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-2-pyrazolin-3-yl]-2-methoxy-benzamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=NN(C(=O)C2C3=NCCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=NN(C(=O)[C@H]2C3=NCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O3/c1-30-19-14-8-7-12-17(19)22(28)25-21-20(18-13-6-3-9-15-24-18)23(29)27(26-21)16-10-4-2-5-11-16/h2,4-5,7-8,10-12,14,20H,3,6,9,13,15H2,1H3,(H,25,26,28)/t20-/m0/s1