3-(azepan-1-ylsulfonyl)-N-(2-pyrazol-1-ylpyridin-3-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2-pyrazol-1-ylpyridin-3-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-pyrazol-1-yl-3-pyridyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(1-pyrazolyl)-3-pyridinyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-pyrazol-1-ylpyridin-3-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-pyrazol-1-yl-3-pyridyl)benzamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C21H23N5O3S/c27-21(24-19-10-6-11-22-20(19)26-15-7-12-23-26)17-8-5-9-18(16-17)30(28,29)25-13-3-1-2-4-14-25/h5-12,15-16H,1-4,13-14H2,(H,24,27)