1-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyl-2-(4-methoxyphenyl)azepane

Systemtic Name: 1-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyl-2-(4-methoxyphenyl)azepane Openeye Name: 1-(5-chloro-1-methyl-imidazol-4-yl)sulfonyl-2-(4-methoxyphenyl)azepane CAS Name: 1-[(5-chloro-1-methyl-4-imidazolyl)sulfonyl]-2-(4-methoxyphenyl)azepane IUPAC Name: 1-(5-chloro-1-methylimidazol-4-yl)sulfonyl-2-(4-methoxyphenyl)azepane Traditional Name: 1-(5-chloro-1-methyl-imidazol-4-yl)sulfonyl-2-(4-methoxyphenyl)azepane Formula: C17H22ClN3O3S MolecularWeight: 383.89288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1Cl)S(=O)(=O)N2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=NC(=C1Cl)S(=O)(=O)N2CCCCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H22ClN3O3S/c1-20-12-19-17(16(20)18)25(22,23)21-11-5-3-4-6-15(21)13-7-9-14(24-2)10-8-13/h7-10,12,15H,3-6,11H2,1-2H3