3,5-dimethyl-4-[[4-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[[4-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-1-yl]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-[(4-methylsulfonylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole Traditional Name: 4-[[4-(4-mesylbenzyl)-1,4-diazepan-1-yl]methyl]-3,5-dimethyl-isoxazole Formula: C19H27N3O3S MolecularWeight: 377.50098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCCN(CC2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCCN(CC2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H27N3O3S/c1-15-19(16(2)25-20-15)14-22-10-4-9-21(11-12-22)13-17-5-7-18(8-6-17)26(3,23)24/h5-8H,4,9-14H2,1-3H3