morpholine-4-sulfinic acid; 8-[(E)-1-phenylpent-2-en-3-yl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one

Systemtic Name: morpholine-4-sulfinic acid; 8-[(E)-1-phenylpent-2-en-3-yl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one Openeye Name: 8-[(E)-1-ethyl-3-phenyl-prop-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid CAS Name: 4-morpholinesulfinic acid; 8-[(E)-1-phenylpent-2-en-3-yl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one IUPAC Name: morpholine-4-sulfinic acid; 8-[(E)-1-phenylpent-2-en-3-yl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one Traditional Name: 8-[(E)-1-ethyl-3-phenyl-prop-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid Formula: C32H37N3O5S MolecularWeight: 575.71828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)C(=CC=C3)C(=CCC4=CC=CC=C4)CC.C1COCCN1S(=O)O

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)C(=CC=C3)/C(=C/CC4=CC=CC=C4)/CC.C1COCCN1S(=O)O

InChI

InChI=1S/C28H28N2O2.C4H9NO3S/c1-3-19-32-25-16-9-8-13-23(25)27-29-26-22(14-10-15-24(26)28(31)30-27)21(4-2)18-17-20-11-6-5-7-12-20;6-9(7)5-1-3-8-4-2-5/h5-16,18H,3-4,17,19H2,1-2H3,(H,29,30,31);1-4H2,(H,6,7)/b21-18+;