1-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-morpholin-4-ylsulfonyl-pyridine-2-thione

Systemtic Name: 1-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-morpholin-4-ylsulfonyl-pyridine-2-thione Openeye Name: 1-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-morpholinosulfonyl-pyridine-2-thione CAS Name: 1-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-5-(4-morpholinylsulfonyl)-2-pyridinethione IUPAC Name: 1-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-5-morpholin-4-ylsulfonylpyridine-2-thione Traditional Name: 1-[[(2,4-dimethylbenzyl)-methyl-amino]methyl]-5-morpholinosulfonyl-pyridine-2-thione Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C20H27N3O3S2/c1-16-4-5-18(17(2)12-16)13-21(3)15-22-14-19(6-7-20(22)27)28(24,25)23-8-10-26-11-9-23/h4-7,12,14H,8-11,13,15H2,1-3H3