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

Systemtic Name: N-cyclopropyl-2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Openeye Name: N-cyclopropyl-2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine CAS Name: N-cyclopropyl-2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinazolinamine IUPAC Name: N-cyclopropyl-2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Traditional Name: cyclopropyl-[2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]quinazolin-4-yl]amine Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

InChI

InChI=1S/C21H19N5O2S/c1-27-15-6-4-5-13(11-15)19-24-18(28-26-19)12-29-21-23-17-8-3-2-7-16(17)20(25-21)22-14-9-10-14/h2-8,11,14H,9-10,12H2,1H3,(H,22,23,25)