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

Systemtic Name: 2-[[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 3-isopropyl-2-[[2-(4-methylanilino)thiazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[2-(4-methylanilino)-4-thiazolyl]methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[[2-(4-methylanilino)-1,3-thiazol-4-yl]methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 3-isopropyl-2-[[2-(p-toluidino)thiazol-4-yl]methylthio]quinazolin-4-one Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C

InChI

InChI=1S/C22H22N4OS2/c1-14(2)26-20(27)18-6-4-5-7-19(18)25-22(26)29-13-17-12-28-21(24-17)23-16-10-8-15(3)9-11-16/h4-12,14H,13H2,1-3H3,(H,23,24)