N-butyl-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-butyl-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-butyl-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-butyl-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-butyl-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-butyl-N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-piperonylamide Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H29N3O4/c1-4-5-16-31(28(33)21-12-15-25-26(17-21)36-18-35-25)20(3)27-30-24-9-7-6-8-23(24)29(34)32(27)22-13-10-19(2)11-14-22/h6-15,17,20H,4-5,16,18H2,1-3H3