(2R)-2-(4-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-azepane

Systemtic Name: (2R)-2-(4-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-azepane Openeye Name: (2R)-2-(4-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-azepane CAS Name: (2R)-2-(4-methoxyphenyl)-1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]azepane IUPAC Name: (2R)-2-(4-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylazepane Traditional Name: (2R)-2-(4-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-azepane Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCCC[C@@H]2C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H27N3O3S/c1-14-19(15(2)21(3)20-14)26(23,24)22-13-7-5-6-8-18(22)16-9-11-17(25-4)12-10-16/h9-12,18H,5-8,13H2,1-4H3/t18-/m1/s1