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

Systemtic Name: N-ethyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-amine Openeye Name: N-ethyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-amine CAS Name: N-ethyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methylthio]-4-quinazolinamine IUPAC Name: N-ethyl-2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-amine Traditional Name: ethyl-[2-[[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methylthio]quinazolin-4-yl]amine Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC3=NN=C(O3)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC3=NN=C(O3)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C22H23N5O4S/c1-5-23-20-14-8-6-7-9-15(14)24-22(25-20)32-12-18-26-27-21(31-18)13-10-16(28-2)19(30-4)17(11-13)29-3/h6-11H,5,12H2,1-4H3,(H,23,24,25)