2-[2-(4-azanyl-1,2,5-oxadiazol-3-yl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]ethanenitrile

Systemtic Name: 2-[2-(4-azanyl-1,2,5-oxadiazol-3-yl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]ethanenitrile Openeye Name: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]acetonitrile CAS Name: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-4,5-bis(4-methoxyphenyl)-1-imidazolyl]acetonitrile IUPAC Name: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]acetonitrile Traditional Name: 2-[2-(4-aminofurazan-3-yl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]acetonitrile Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(C(=N2)C3=NON=C3N)CC#N)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(C(=N2)C3=NON=C3N)CC#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H18N6O3/c1-28-15-7-3-13(4-8-15)17-19(14-5-9-16(29-2)10-6-14)27(12-11-22)21(24-17)18-20(23)26-30-25-18/h3-10H,12H2,1-2H3,(H2,23,26)