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

Systemtic Name: 3-[(4-ethylsulfonyl-1,4-diazepan-1-yl)methyl]-5-methyl-1,2-oxazole Openeye Name: 3-[(4-ethylsulfonyl-1,4-diazepan-1-yl)methyl]-5-methyl-isoxazole CAS Name: 3-[(4-ethylsulfonyl-1,4-diazepan-1-yl)methyl]-5-methylisoxazole IUPAC Name: 3-[(4-ethylsulfonyl-1,4-diazepan-1-yl)methyl]-5-methyl-1,2-oxazole Traditional Name: 3-[(4-esyl-1,4-diazepan-1-yl)methyl]-5-methyl-isoxazole Formula: C12H21N3O3S MolecularWeight: 287.37844

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCN(CC1)CC2=NOC(=C2)C

Isomeric SMILES

CCS(=O)(=O)N1CCCN(CC1)CC2=NOC(=C2)C

InChI

InChI=1S/C12H21N3O3S/c1-3-19(16,17)15-6-4-5-14(7-8-15)10-12-9-11(2)18-13-12/h9H,3-8,10H2,1-2H3