[4-(azepan-1-ylsulfonyl)phenyl]-(1-butylimidazol-2-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)phenyl]-(1-butylimidazol-2-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)phenyl]-(1-butylimidazol-2-yl)methanone CAS Name: [4-(1-azepanylsulfonyl)phenyl]-(1-butyl-2-imidazolyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)phenyl]-(1-butylimidazol-2-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-(1-butylimidazol-2-yl)methanone Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CN=C1C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCN1C=CN=C1C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O3S/c1-2-3-13-22-16-12-21-20(22)19(24)17-8-10-18(11-9-17)27(25,26)23-14-6-4-5-7-15-23/h8-12,16H,2-7,13-15H2,1H3