N-(3-azanyl-2-oxidanyl-4-phenyl-butyl)-N-(4-cyano-2,2-dimethyl-butyl)-1,3-benzodioxole-5-sulfonamide hydrochloride

Systemtic Name: N-(3-azanyl-2-oxidanyl-4-phenyl-butyl)-N-(4-cyano-2,2-dimethyl-butyl)-1,3-benzodioxole-5-sulfonamide hydrochloride Openeye Name: N-(3-amino-2-hydroxy-4-phenyl-butyl)-N-(4-cyano-2,2-dimethyl-butyl)-1,3-benzodioxole-5-sulfonamide hydrochloride CAS Name: N-(3-amino-2-hydroxy-4-phenylbutyl)-N-(4-cyano-2,2-dimethylbutyl)-1,3-benzodioxole-5-sulfonamide hydrochloride IUPAC Name: N-(3-amino-2-hydroxy-4-phenylbutyl)-N-(4-cyano-2,2-dimethylbutyl)-1,3-benzodioxole-5-sulfonamide hydrochloride Traditional Name: N-(3-amino-2-hydroxy-4-phenyl-butyl)-N-(4-cyano-2,2-dimethyl-butyl)-1,3-benzodioxole-5-sulfonamide hydrochloride Formula: C24H32ClN3O5S MolecularWeight: 510.04598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC#N)CN(CC(C(CC1=CC=CC=C1)N)O)S(=O)(=O)C2=CC3=C(C=C2)OCO3.Cl

Isomeric SMILES

CC(C)(CCC#N)CN(CC(C(CC1=CC=CC=C1)N)O)S(=O)(=O)C2=CC3=C(C=C2)OCO3.Cl

InChI

InChI=1S/C24H31N3O5S.ClH/c1-24(2,11-6-12-25)16-27(15-21(28)20(26)13-18-7-4-3-5-8-18)33(29,30)19-9-10-22-23(14-19)32-17-31-22;/h3-5,7-10,14,20-21,28H,6,11,13,15-17,26H2,1-2H3;1H