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

Systemtic Name: 2-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[[2-(p-tolyl)thiazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[2-(4-methylphenyl)-4-thiazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[2-(p-tolyl)thiazol-4-yl]methylthio]quinazolin-4-one Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

InChI

InChI=1S/C22H21N3O2S2/c1-15-7-9-16(10-8-15)20-23-17(13-28-20)14-29-22-24-19-6-3-2-5-18(19)21(27)25(22)11-4-12-26/h2-3,5-10,13,26H,4,11-12,14H2,1H3