1,2-dimethyl-5-quinoxalin-6-yl-4-(3-thiomorpholin-4-ylcarbonylphenyl)pyrazol-3-one

Systemtic Name: 1,2-dimethyl-5-quinoxalin-6-yl-4-(3-thiomorpholin-4-ylcarbonylphenyl)pyrazol-3-one Openeye Name: 1,2-dimethyl-5-quinoxalin-6-yl-4-[3-(thiomorpholine-4-carbonyl)phenyl]pyrazol-3-one CAS Name: 1,2-dimethyl-4-[3-[oxo(thiomorpholin-4-yl)methyl]phenyl]-5-(6-quinoxalinyl)-3-pyrazolone IUPAC Name: 1,2-dimethyl-5-quinoxalin-6-yl-4-[3-(thiomorpholine-4-carbonyl)phenyl]pyrazol-3-one Traditional Name: 1,2-dimethyl-5-quinoxalin-6-yl-4-[3-(thiomorpholine-4-carbonyl)phenyl]-3-pyrazolin-3-one Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C)C2=CC(=CC=C2)C(=O)N3CCSCC3)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CN1C(=C(C(=O)N1C)C2=CC(=CC=C2)C(=O)N3CCSCC3)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C24H23N5O2S/c1-27-22(17-6-7-19-20(15-17)26-9-8-25-19)21(24(31)28(27)2)16-4-3-5-18(14-16)23(30)29-10-12-32-13-11-29/h3-9,14-15H,10-13H2,1-2H3