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

Systemtic Name: N-cyclopropyl-2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Openeye Name: N-cyclopropyl-2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine CAS Name: N-cyclopropyl-2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinazolinamine IUPAC Name: N-cyclopropyl-2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Traditional Name: cyclopropyl-[2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]quinazolin-4-yl]amine Formula: C22H21N5O3S MolecularWeight: 435.49884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O3S/c1-28-17-10-7-13(11-18(17)29-2)20-25-19(30-27-20)12-31-22-24-16-6-4-3-5-15(16)21(26-22)23-14-8-9-14/h3-7,10-11,14H,8-9,12H2,1-2H3,(H,23,24,26)