1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-tert-butyl-3,5-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-tert-butyl-3,5-dimethyl-pyrazole-4-sulfonamide Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-N-tert-butyl-3,5-dimethyl-pyrazole-4-sulfonamide CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-N-tert-butyl-3,5-dimethyl-4-pyrazolesulfonamide IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-N-tert-butyl-3,5-dimethylpyrazole-4-sulfonamide Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-N-tert-butyl-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C17H30N4O3S MolecularWeight: 370.5101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCCCCC2)C)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCCCCC2)C)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C17H30N4O3S/c1-13-16(25(23,24)19-17(3,4)5)14(2)21(18-13)12-15(22)20-10-8-6-7-9-11-20/h19H,6-12H2,1-5H3