4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-1,4-oxazepane

Systemtic Name: 4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-1,4-oxazepane Openeye Name: 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-1,4-oxazepane CAS Name: 4-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-1,4-oxazepane IUPAC Name: 4-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-1,4-oxazepane Traditional Name: 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-1,4-oxazepane Formula: C10H16ClN3O3S MolecularWeight: 293.77034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)N2CCCOCC2)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)N2CCCOCC2)Cl)C

InChI

InChI=1S/C10H16ClN3O3S/c1-8-9(10(11)13(2)12-8)18(15,16)14-4-3-6-17-7-5-14/h3-7H2,1-2H3