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

Systemtic Name: 6-(4-bromanyl-2-methoxy-phenoxy)-5-nitro-N-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine Openeye Name: 6-(4-bromo-2-methoxy-phenoxy)-5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine CAS Name: 6-(4-bromo-2-methoxyphenoxy)-5-nitro-N-[[4-(4-thiadiazolyl)phenyl]methyl]-4-pyrimidinamine IUPAC Name: 6-(4-bromo-2-methoxyphenoxy)-5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]pyrimidin-4-amine Traditional Name: [6-(4-bromo-2-methoxy-phenoxy)-5-nitro-pyrimidin-4-yl]-[4-(thiadiazol-4-yl)benzyl]amine Formula: C20H15BrN6O4S MolecularWeight: 515.3399

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Br)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)C4=CSN=N4

Isomeric SMILES

COC1=C(C=CC(=C1)Br)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)C4=CSN=N4

InChI

InChI=1S/C20H15BrN6O4S/c1-30-17-8-14(21)6-7-16(17)31-20-18(27(28)29)19(23-11-24-20)22-9-12-2-4-13(5-3-12)15-10-32-26-25-15/h2-8,10-11H,9H2,1H3,(H,22,23,24)