1-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyl-4-[(2-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyl-4-[(2-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-(5-chloro-1-methyl-imidazol-4-yl)sulfonyl-4-(o-tolylmethyl)-1,4-diazepane CAS Name: 1-[(5-chloro-1-methyl-4-imidazolyl)sulfonyl]-4-[(2-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(5-chloro-1-methylimidazol-4-yl)sulfonyl-4-[(2-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-(5-chloro-1-methyl-imidazol-4-yl)sulfonyl-4-(2-methylbenzyl)-1,4-diazepane Formula: C17H23ClN4O2S MolecularWeight: 382.90812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)S(=O)(=O)C3=C(N(C=N3)C)Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)S(=O)(=O)C3=C(N(C=N3)C)Cl

InChI

InChI=1S/C17H23ClN4O2S/c1-14-6-3-4-7-15(14)12-21-8-5-9-22(11-10-21)25(23,24)17-16(18)20(2)13-19-17/h3-4,6-7,13H,5,8-12H2,1-2H3