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

Systemtic Name: 2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[[2-(4-methoxyphenyl)thiazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[2-(4-methoxyphenyl)-4-thiazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[2-(4-methoxyphenyl)thiazol-4-yl]methylthio]quinazolin-4-one Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

InChI

InChI=1S/C22H21N3O3S2/c1-28-17-9-7-15(8-10-17)20-23-16(13-29-20)14-30-22-24-19-6-3-2-5-18(19)21(27)25(22)11-4-12-26/h2-3,5-10,13,26H,4,11-12,14H2,1H3