1-[(2S)-2-(4-methoxyphenyl)-3-(phenylsulfonyl)-1,3-diazinan-1-yl]propan-1-one

Systemtic Name: 1-[(2S)-2-(4-methoxyphenyl)-3-(phenylsulfonyl)-1,3-diazinan-1-yl]propan-1-one Openeye Name: 1-[(2S)-3-(benzenesulfonyl)-2-(4-methoxyphenyl)hexahydropyrimidin-1-yl]propan-1-one CAS Name: 1-[(2S)-3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-diazinan-1-yl]-1-propanone IUPAC Name: 1-[(2S)-3-(benzenesulfonyl)-2-(4-methoxyphenyl)-1,3-diazinan-1-yl]propan-1-one Traditional Name: 1-[(2S)-3-besyl-2-(4-methoxyphenyl)hexahydropyrimidin-1-yl]propan-1-one Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCN(C1C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCCN([C@H]1C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O4S/c1-3-19(23)21-14-7-15-22(27(24,25)18-8-5-4-6-9-18)20(21)16-10-12-17(26-2)13-11-16/h4-6,8-13,20H,3,7,14-15H2,1-2H3/t20-/m0/s1