4-[[(9S)-11-butyl-9-(2-methylpropyl)-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethyl-benzenesulfonamide hydrochloride

Systemtic Name: 4-[[(9S)-11-butyl-9-(2-methylpropyl)-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethyl-benzenesulfonamide hydrochloride Openeye Name: 4-[[(9S)-11-butyl-9-isobutyl-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethyl-benzenesulfonamide hydrochloride CAS Name: 4-[[(9S)-11-butyl-9-(2-methylpropyl)-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethylbenzenesulfonamide hydrochloride IUPAC Name: 4-[[(9S)-11-butyl-9-(2-methylpropyl)-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethylbenzenesulfonamide hydrochloride Traditional Name: 4-[[(9S)-11-butyl-9-isobutyl-7,10-diketo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]-N,N-dimethyl-benzenesulfonamide hydrochloride Formula: C25H41ClN4O4S MolecularWeight: 529.13544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)S(=O)(=O)N(C)C)CC(C)C.Cl

Isomeric SMILES

CCCCN1C(=O)[C@@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)S(=O)(=O)N(C)C)CC(C)C.Cl

InChI

InChI=1S/C25H40N4O4S.ClH/c1-6-7-14-29-23(30)22(17-19(2)3)26-24(31)25(29)12-15-28(16-13-25)18-20-8-10-21(11-9-20)34(32,33)27(4)5;/h8-11,19,22H,6-7,12-18H2,1-5H3,(H,26,31);1H/t22-;/m0./s1