2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholin-4-ylpropyl)-1,3-thiazinan-4-one

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholin-4-ylpropyl)-1,3-thiazinan-4-one Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholinopropyl)-1,3-thiazinan-4-one CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-[3-(4-morpholinyl)propyl]-1,3-thiazinan-4-one IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(3-morpholin-4-ylpropyl)-1,3-thiazinan-4-one Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholinopropyl)-1,3-thiazinan-4-one Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CCS3)CCCN4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3N(C(=O)CCS3)CCCN4CCOCC4

InChI

InChI=1S/C22H30N4O2S/c1-17-21(18(2)26(23-17)19-7-4-3-5-8-19)22-25(20(27)9-16-29-22)11-6-10-24-12-14-28-15-13-24/h3-5,7-8,22H,6,9-16H2,1-2H3