(2S)-3-(1,3-benzodioxol-5-yl)-2-(5-thiophen-2-yl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(5-thiophen-2-yl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-[5-(2-thienyl)-1H-pyrazol-4-yl]-1,2-dihydroquinazolin-4-one CAS Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(5-thiophen-2-yl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-(5-thiophen-2-yl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-3-(1,3-benzodioxol-5-yl)-2-[5-(2-thienyl)-1H-pyrazol-4-yl]-1,2-dihydroquinazolin-4-one Formula: C22H16N4O3S MolecularWeight: 416.45244

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C(NC4=CC=CC=C4C3=O)C5=C(NN=C5)C6=CC=CS6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3[C@H](NC4=CC=CC=C4C3=O)C5=C(NN=C5)C6=CC=CS6

InChI

InChI=1S/C22H16N4O3S/c27-22-14-4-1-2-5-16(14)24-21(15-11-23-25-20(15)19-6-3-9-30-19)26(22)13-7-8-17-18(10-13)29-12-28-17/h1-11,21,24H,12H2,(H,23,25)/t21-/m0/s1