6-[(3S)-2-(phenylsulfonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]quinoxaline

Systemtic Name: 6-[(3S)-2-(phenylsulfonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]quinoxaline Openeye Name: 6-[(3S)-2-(benzenesulfonyl)-5-(2-thienyl)-3,4-dihydropyrazol-3-yl]quinoxaline CAS Name: 6-[(3S)-2-(benzenesulfonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]quinoxaline IUPAC Name: 6-[(3S)-2-(benzenesulfonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]quinoxaline Traditional Name: 6-[(3S)-2-besyl-5-(2-thienyl)-2-pyrazolin-3-yl]quinoxaline Formula: C21H16N4O2S2 MolecularWeight: 420.50734

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)S(=O)(=O)C3=CC=CC=C3)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=CS2)S(=O)(=O)C3=CC=CC=C3)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C21H16N4O2S2/c26-29(27,16-5-2-1-3-6-16)25-20(14-19(24-25)21-7-4-12-28-21)15-8-9-17-18(13-15)23-11-10-22-17/h1-13,20H,14H2/t20-/m0/s1