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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,5-dimethyl-1H-pyrrol-3-yl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,5-dimethyl-1H-pyrrol-3-yl)-1,2-dihydroquinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,5-dimethyl-1H-pyrrol-3-yl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,5-dimethyl-1H-pyrrol-3-yl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(2,5-dimethyl-1H-pyrrol-3-yl)-3-piperonyl-1,2-dihydroquinazolin-4-one Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(N1)C)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O3/c1-13-9-17(14(2)23-13)21-24-18-6-4-3-5-16(18)22(26)25(21)11-15-7-8-19-20(10-15)28-12-27-19/h3-10,21,23-24H,11-12H2,1-2H3