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

Systemtic Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholinopropyl)-2-thioxo-imidazolidin-4-one CAS Name: (5S)-5-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-[3-(4-morpholinyl)propyl]-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5S)-5-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(3-morpholin-4-ylpropyl)-2-sulfanylideneimidazolidin-4-one Traditional Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(3-morpholinopropyl)-2-thioxo-4-imidazolidinone Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)N(C(=S)N3)CCCN4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)[C@H]3C(=O)N(C(=S)N3)CCCN4CCOCC4

InChI

InChI=1S/C21H27N5O2S/c1-15-18(16(2)26(23-15)17-7-4-3-5-8-17)19-20(27)25(21(29)22-19)10-6-9-24-11-13-28-14-12-24/h3-5,7-8,19H,6,9-14H2,1-2H3,(H,22,29)/t19-/m0/s1