1-[3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-pyrrolidin-1-yl-ethanone

Systemtic Name: 1-[3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-pyrrolidin-1-yl-ethanone Openeye Name: 1-[3-(p-tolylsulfonyl)hexahydropyrimidin-1-yl]-2-pyrrolidin-1-yl-ethanone CAS Name: 1-[3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-(1-pyrrolidinyl)ethanone IUPAC Name: 1-[3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-pyrrolidin-1-ylethanone Traditional Name: 2-pyrrolidino-1-(3-tosylhexahydropyrimidin-1-yl)ethanone Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2)C(=O)CN3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2)C(=O)CN3CCCC3

InChI

InChI=1S/C17H25N3O3S/c1-15-5-7-16(8-6-15)24(22,23)20-12-4-11-19(14-20)17(21)13-18-9-2-3-10-18/h5-8H,2-4,9-14H2,1H3