2-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one

Systemtic Name: 2-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 2-[2-(2,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-3-propyl-quinazolin-4-one CAS Name: 2-[[2-(2,4-dimethoxyphenyl)-2-oxoethyl]thio]-3-propyl-4-quinazolinone IUPAC Name: 2-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 2-[[2-(2,4-dimethoxyphenyl)-2-keto-ethyl]thio]-3-propyl-quinazolin-4-one Formula: C21H22N2O4S MolecularWeight: 398.47538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O4S/c1-4-11-23-20(25)15-7-5-6-8-17(15)22-21(23)28-13-18(24)16-10-9-14(26-2)12-19(16)27-3/h5-10,12H,4,11,13H2,1-3H3