N-[1-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethyl]methanesulfonamide sulfate hydrate

Systemtic Name: N-[1-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethyl]methanesulfonamide sulfate hydrate Openeye Name: N-[1-(4-amino-N-ethyl-3-methyl-anilino)ethyl]methanesulfonamide sulfate hydrate CAS Name: N-[1-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide sulfate hydrate IUPAC Name: N-[1-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide sulfate hydrate Traditional Name: N-[1-(4-amino-N-ethyl-3-methyl-anilino)ethyl]methanesulfonamide sulfate hydrate Formula: C12H23N3O7S2-2 MolecularWeight: 385.45692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C12H21N3O2S.H2O4S.H2O/c1-5-15(10(3)14-18(4,16)17)11-6-7-12(13)9(2)8-11;1-5(2,3)4;/h6-8,10,14H,5,13H2,1-4H3;(H2,1,2,3,4);1H2/p-2