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

Systemtic Name: N-ethyl-2-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-amine Openeye Name: 2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-N-ethyl-quinazolin-4-amine CAS Name: N-ethyl-2-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinazolinamine IUPAC Name: 2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-N-ethylquinazolin-4-amine Traditional Name: [2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylthio]quinazolin-4-yl]-ethyl-amine Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC3=NC(=NO3)CC4=CC=CC=C4

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC3=NC(=NO3)CC4=CC=CC=C4

InChI

InChI=1S/C20H19N5OS/c1-2-21-19-15-10-6-7-11-16(15)22-20(24-19)27-13-18-23-17(25-26-18)12-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,21,22,24)