6-(4-imidazol-1-ylphenoxy)-5-nitro-N-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine

Systemtic Name: 6-(4-imidazol-1-ylphenoxy)-5-nitro-N-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine Openeye Name: 6-(4-imidazol-1-ylphenoxy)-5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine CAS Name: 6-[4-(1-imidazolyl)phenoxy]-5-nitro-N-[[4-(4-thiadiazolyl)phenyl]methyl]-4-pyrimidinamine IUPAC Name: 6-(4-imidazol-1-ylphenoxy)-5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine Traditional Name: [6-(4-imidazol-1-ylphenoxy)-5-nitro-pyrimidin-4-yl]-[4-(thiadiazol-4-yl)benzyl]amine Formula: C22H16N8O3S MolecularWeight: 472.47924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C(=NC=N2)OC3=CC=C(C=C3)N4C=CN=C4)[N+](=O)[O-])C5=CSN=N5

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C(=NC=N2)OC3=CC=C(C=C3)N4C=CN=C4)[N+](=O)[O-])C5=CSN=N5

InChI

InChI=1S/C22H16N8O3S/c31-30(32)20-21(24-11-15-1-3-16(4-2-15)19-12-34-28-27-19)25-13-26-22(20)33-18-7-5-17(6-8-18)29-10-9-23-14-29/h1-10,12-14H,11H2,(H,24,25,26)