3-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3-piperonyl-1,2-dihydroquinazolin-4-one Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=NN1)C)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H20N4O3/c1-12-19(13(2)24-23-12)20-22-16-6-4-3-5-15(16)21(26)25(20)10-14-7-8-17-18(9-14)28-11-27-17/h3-9,20,22H,10-11H2,1-2H3,(H,23,24)