2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-4-thiazolyl]methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C21H18ClN3O2S2 MolecularWeight: 443.96952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CSC(=N3)C4=CC=C(C=C4)Cl)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CSC(=N3)C4=CC=C(C=C4)Cl)CCCO

InChI

InChI=1S/C21H18ClN3O2S2/c22-15-8-6-14(7-9-15)19-23-16(12-28-19)13-29-21-24-18-5-2-1-4-17(18)20(27)25(21)10-3-11-26/h1-2,4-9,12,26H,3,10-11,13H2