1-[(2S)-2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-piperidin-1-yl-ethanone

Systemtic Name: 1-[(2S)-2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-piperidin-1-yl-ethanone Openeye Name: 1-[(2S)-2-(4-methoxyphenyl)-3-(p-tolylsulfonyl)hexahydropyrimidin-1-yl]-2-(1-piperidyl)ethanone CAS Name: 1-[(2S)-2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-(1-piperidinyl)ethanone IUPAC Name: 1-[(2S)-2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,3-diazinan-1-yl]-2-piperidin-1-ylethanone Traditional Name: 1-[(2S)-2-(4-methoxyphenyl)-3-tosyl-hexahydropyrimidin-1-yl]-2-piperidino-ethanone Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2C3=CC=C(C=C3)OC)C(=O)CN4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN([C@@H]2C3=CC=C(C=C3)OC)C(=O)CN4CCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-20-7-13-23(14-8-20)33(30,31)28-18-6-17-27(24(29)19-26-15-4-3-5-16-26)25(28)21-9-11-22(32-2)12-10-21/h7-14,25H,3-6,15-19H2,1-2H3/t25-/m0/s1