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

Systemtic Name: N-butyl-N-[1-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-butyl-N-[1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-butyl-N-[1-[3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]propyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-butyl-N-[1-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]propyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-butyl-N-[1-[3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]propyl]-piperonylamide Formula: C29H28ClN3O4 MolecularWeight: 518.00332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28ClN3O4/c1-3-5-16-32(28(34)19-10-15-25-26(17-19)37-18-36-25)24(4-2)27-31-23-9-7-6-8-22(23)29(35)33(27)21-13-11-20(30)12-14-21/h6-15,17,24H,3-5,16,18H2,1-2H3