6-chloranyl-2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-(2-indan-5-yl-2-oxo-ethyl)sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[(2-indan-5-yl-2-keto-ethyl)thio]quinazolin-4-one Formula: C22H19ClN2O2S MolecularWeight: 410.91646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H19ClN2O2S/c1-2-10-25-21(27)18-12-17(23)8-9-19(18)24-22(25)28-13-20(26)16-7-6-14-4-3-5-15(14)11-16/h2,6-9,11-12H,1,3-5,10,13H2