2-[4-[[5-(3-azanyl-2-methyl-phenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-bis(chloranyl)phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[4-[[5-(3-azanyl-2-methyl-phenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-bis(chloranyl)phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-[[5-(3-amino-2-methyl-phenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-dichloro-phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[4-[[5-(3-amino-2-methylphenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-dichlorophenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-[[5-(3-amino-2-methylphenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-dichlorophenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-[[5-(3-amino-2-methyl-phenyl)-1,3,4-oxadiazol-2-yl]-(4-chlorophenyl)methyl]-3,5-dichloro-phenyl]-1,2,4-triazine-3,5-quinone Formula: C25H17Cl3N6O3 MolecularWeight: 555.79988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C2=NN=C(O2)C(C3=CC=C(C=C3)Cl)C4=C(C=C(C=C4Cl)N5C(=O)NC(=O)C=N5)Cl

Isomeric SMILES

CC1=C(C=CC=C1N)C2=NN=C(O2)C(C3=CC=C(C=C3)Cl)C4=C(C=C(C=C4Cl)N5C(=O)NC(=O)C=N5)Cl

InChI

InChI=1S/C25H17Cl3N6O3/c1-12-16(3-2-4-19(12)29)23-32-33-24(37-23)21(13-5-7-14(26)8-6-13)22-17(27)9-15(10-18(22)28)34-25(36)31-20(35)11-30-34/h2-11,21H,29H2,1H3,(H,31,35,36)