8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid

Systemtic Name: 8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid Openeye Name: 8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid CAS Name: 8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; 4-morpholinesulfinic acid IUPAC Name: 8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid Traditional Name: 8-[(E)-hept-1-enyl]-2-(2-propoxyphenyl)-1H-quinazolin-4-one; morpholine-4-sulfinic acid Formula: C28H37N3O5S MolecularWeight: 527.67548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC1=CC=CC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC.C1COCCN1S(=O)O

Isomeric SMILES

CCCCC/C=C/C1=CC=CC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC.C1COCCN1S(=O)O

InChI

InChI=1S/C24H28N2O2.C4H9NO3S/c1-3-5-6-7-8-12-18-13-11-15-20-22(18)25-23(26-24(20)27)19-14-9-10-16-21(19)28-17-4-2;6-9(7)5-1-3-8-4-2-5/h8-16H,3-7,17H2,1-2H3,(H,25,26,27);1-4H2,(H,6,7)/b12-8+;