[2-(1-methylpyrrol-2-yl)azepan-1-yl]-(1-phenylpyrazol-4-yl)methanone

Systemtic Name: [2-(1-methylpyrrol-2-yl)azepan-1-yl]-(1-phenylpyrazol-4-yl)methanone Openeye Name: [2-(1-methylpyrrol-2-yl)azepan-1-yl]-(1-phenylpyrazol-4-yl)methanone CAS Name: [2-(1-methyl-2-pyrrolyl)-1-azepanyl]-(1-phenyl-4-pyrazolyl)methanone IUPAC Name: [2-(1-methylpyrrol-2-yl)azepan-1-yl]-(1-phenylpyrazol-4-yl)methanone Traditional Name: [2-(1-methylpyrrol-2-yl)azepan-1-yl]-(1-phenylpyrazol-4-yl)methanone Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O/c1-23-13-8-12-19(23)20-11-6-3-7-14-24(20)21(26)17-15-22-25(16-17)18-9-4-2-5-10-18/h2,4-5,8-10,12-13,15-16,20H,3,6-7,11,14H2,1H3