1-(1,3-benzodioxol-5-yl)-3-[3-(3-methoxypropyl)-2-oxidanylidene-quinazolin-4-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(3-methoxypropyl)-2-oxidanylidene-quinazolin-4-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(3-methoxypropyl)-2-oxo-quinazolin-4-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(3-methoxypropyl)-2-oxo-4-quinazolinyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(3-methoxypropyl)-2-oxoquinazolin-4-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-keto-3-(3-methoxypropyl)quinazolin-4-yl]urea Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=C2C=CC=CC2=NC1=O)NC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCCCN1C(=C2C=CC=CC2=NC1=O)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O5/c1-27-10-4-9-24-18(14-5-2-3-6-15(14)22-20(24)26)23-19(25)21-13-7-8-16-17(11-13)29-12-28-16/h2-3,5-8,11H,4,9-10,12H2,1H3,(H2,21,23,25)