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

Systemtic Name: 4-(1-benzothiophen-3-yl)-1,2-dimethyl-5-quinoxalin-6-yl-pyrazol-3-one Openeye Name: 4-(benzothiophen-3-yl)-1,2-dimethyl-5-quinoxalin-6-yl-pyrazol-3-one CAS Name: 4-(1-benzothiophen-3-yl)-1,2-dimethyl-5-(6-quinoxalinyl)-3-pyrazolone IUPAC Name: 4-(1-benzothiophen-3-yl)-1,2-dimethyl-5-quinoxalin-6-ylpyrazol-3-one Traditional Name: 4-(benzothiophen-3-yl)-1,2-dimethyl-5-quinoxalin-6-yl-3-pyrazolin-3-one Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C)C2=CSC3=CC=CC=C32)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CN1C(=C(C(=O)N1C)C2=CSC3=CC=CC=C32)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C21H16N4OS/c1-24-20(13-7-8-16-17(11-13)23-10-9-22-16)19(21(26)25(24)2)15-12-27-18-6-4-3-5-14(15)18/h3-12H,1-2H3