N-[(2R)-6-bromanyl-4-oxidanylidene-2-(4-pentoxyphenyl)-1,2-dihydroquinazolin-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2R)-6-bromanyl-4-oxidanylidene-2-(4-pentoxyphenyl)-1,2-dihydroquinazolin-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2R)-6-bromo-4-oxo-2-(4-pentoxyphenyl)-1,2-dihydroquinazolin-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(2R)-6-bromo-4-oxo-2-(4-pentoxyphenyl)-1,2-dihydroquinazolin-3-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2R)-6-bromo-4-oxo-2-(4-pentoxyphenyl)-1,2-dihydroquinazolin-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2R)-2-(4-amoxyphenyl)-6-bromo-4-keto-1,2-dihydroquinazolin-3-yl]-piperonylamide Formula: C27H26BrN3O5 MolecularWeight: 552.41644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2NC3=C(C=C(C=C3)Br)C(=O)N2NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)[C@@H]2NC3=C(C=C(C=C3)Br)C(=O)N2NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H26BrN3O5/c1-2-3-4-13-34-20-9-5-17(6-10-20)25-29-22-11-8-19(28)15-21(22)27(33)31(25)30-26(32)18-7-12-23-24(14-18)36-16-35-23/h5-12,14-15,25,29H,2-4,13,16H2,1H3,(H,30,32)/t25-/m1/s1