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

Systemtic Name: (2S)-3-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-yl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-3-(1,3-benzodioxol-5-ylmethyl)-2-(2-thienyl)-1,2-dihydroquinazolin-4-one CAS Name: (2S)-3-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-yl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-3-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-yl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-3-piperonyl-2-(2-thienyl)-1,2-dihydroquinazolin-4-one Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(NC4=CC=CC=C4C3=O)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3[C@H](NC4=CC=CC=C4C3=O)C5=CC=CS5

InChI

InChI=1S/C20H16N2O3S/c23-20-14-4-1-2-5-15(14)21-19(18-6-3-9-26-18)22(20)11-13-7-8-16-17(10-13)25-12-24-16/h1-10,19,21H,11-12H2/t19-/m0/s1