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

Systemtic Name: N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-phenethyl-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-phenethyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-N-phenethyl-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]-N-phenethyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]-N-phenethyl-piperonylamide Formula: C35H33N3O4 MolecularWeight: 559.65422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CC)N(CCC4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CC)N(CCC4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C35H33N3O4/c1-3-24-14-17-27(18-15-24)38-33(36-29-13-9-8-12-28(29)35(38)40)30(4-2)37(21-20-25-10-6-5-7-11-25)34(39)26-16-19-31-32(22-26)42-23-41-31/h5-19,22,30H,3-4,20-21,23H2,1-2H3