1-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-5-pyrrolidin-1-ylsulfonyl-pyridine-2-thione

Systemtic Name: 1-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-5-pyrrolidin-1-ylsulfonyl-pyridine-2-thione Openeye Name: 1-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-5-pyrrolidin-1-ylsulfonyl-pyridine-2-thione CAS Name: 1-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-5-(1-pyrrolidinylsulfonyl)-2-pyridinethione IUPAC Name: 1-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-5-pyrrolidin-1-ylsulfonylpyridine-2-thione Traditional Name: 1-[[[4-(dimethylamino)benzyl]-methyl-amino]methyl]-5-pyrrolidinosulfonyl-pyridine-2-thione Formula: C20H28N4O2S2 MolecularWeight: 420.59192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H28N4O2S2/c1-21(2)18-8-6-17(7-9-18)14-22(3)16-23-15-19(10-11-20(23)27)28(25,26)24-12-4-5-13-24/h6-11,15H,4-5,12-14,16H2,1-3H3