5-(azepan-1-ylsulfonyl)-2-chloranyl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(3-pyridylmethyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(3-pyridylmethyl)benzamide Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C19H22ClN3O3S/c20-18-8-7-16(27(25,26)23-10-3-1-2-4-11-23)12-17(18)19(24)22-14-15-6-5-9-21-13-15/h5-9,12-13H,1-4,10-11,14H2,(H,22,24)