5-methyl-3-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole

Systemtic Name: 5-methyl-3-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole Openeye Name: 5-methyl-3-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methyl]isoxazole CAS Name: 5-methyl-3-[[4-(8-quinolinylsulfonyl)-1,4-diazepan-1-yl]methyl]isoxazole IUPAC Name: 5-methyl-3-[(4-quinolin-8-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole Traditional Name: 5-methyl-3-[[4-(8-quinolylsulfonyl)-1,4-diazepan-1-yl]methyl]isoxazole Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C19H22N4O3S/c1-15-13-17(21-26-15)14-22-9-4-10-23(12-11-22)27(24,25)18-7-2-5-16-6-3-8-20-19(16)18/h2-3,5-8,13H,4,9-12,14H2,1H3