N-cyclopropyl-2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine

Systemtic Name: N-cyclopropyl-2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Openeye Name: N-cyclopropyl-2-[[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine CAS Name: N-cyclopropyl-2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinazolinamine IUPAC Name: N-cyclopropyl-2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Traditional Name: cyclopropyl-[2-[[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]quinazolin-4-yl]amine Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

InChI

InChI=1S/C21H19N5OS/c1-13-6-2-3-7-15(13)20-24-18(27-26-20)12-28-21-23-17-9-5-4-8-16(17)19(25-21)22-14-10-11-14/h2-9,14H,10-12H2,1H3,(H,22,23,25)