N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]acetamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H24N4O3/c1-25(14-17-13-23-26(15-17)19-6-3-2-4-7-19)16-22(27)24-18-8-9-20-21(12-18)29-11-5-10-28-20/h2-4,6-9,12-13,15H,5,10-11,14,16H2,1H3,(H,24,27)