5-methyl-3-[[4-(1-methylimidazol-4-yl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,2-oxazole

Systemtic Name: 5-methyl-3-[[4-(1-methylimidazol-4-yl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,2-oxazole Openeye Name: 5-methyl-3-[[4-(1-methylimidazol-4-yl)sulfonyl-1,4-diazepan-1-yl]methyl]isoxazole CAS Name: 5-methyl-3-[[4-[(1-methyl-4-imidazolyl)sulfonyl]-1,4-diazepan-1-yl]methyl]isoxazole IUPAC Name: 5-methyl-3-[[4-(1-methylimidazol-4-yl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,2-oxazole Traditional Name: 5-methyl-3-[[4-(1-methylimidazol-4-yl)sulfonyl-1,4-diazepan-1-yl]methyl]isoxazole Formula: C14H21N5O3S MolecularWeight: 339.41324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)S(=O)(=O)C3=CN(C=N3)C

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)S(=O)(=O)C3=CN(C=N3)C

InChI

InChI=1S/C14H21N5O3S/c1-12-8-13(16-22-12)9-18-4-3-5-19(7-6-18)23(20,21)14-10-17(2)11-15-14/h8,10-11H,3-7,9H2,1-2H3