3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(1-methylpyrazol-3-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(1-methylpyrazol-3-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1-methylpyrazol-3-yl)benzamide Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H21ClN4O3S/c1-21-11-8-16(20-21)19-17(23)13-6-7-14(18)15(12-13)26(24,25)22-9-4-2-3-5-10-22/h6-8,11-12H,2-5,9-10H2,1H3,(H,19,20,23)