1-(1-methylimidazol-4-yl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-(1-methylimidazol-4-yl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-(1-methylimidazol-4-yl)sulfonyl-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(1-methyl-4-imidazolyl)sulfonyl]-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-(1-methylimidazol-4-yl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-(1-methylimidazol-4-yl)sulfonyl-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane Formula: C16H23N5O2S MolecularWeight: 349.45112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)C3=CN(C=N3)C

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)C3=CN(C=N3)C

InChI

InChI=1S/C16H23N5O2S/c1-14-5-3-6-15(18-14)11-20-7-4-8-21(10-9-20)24(22,23)16-12-19(2)13-17-16/h3,5-6,12-13H,4,7-11H2,1-2H3