7-[2,3-bis(chloranyl)phenyl]-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

Systemtic Name: 7-[2,3-bis(chloranyl)phenyl]-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 7-(2,3-dichlorophenyl)-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 7-(2,3-dichlorophenyl)-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 7-(2,3-dichlorophenyl)-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 7-(2,3-dichlorophenyl)-2-(4-dimethylaminophenyl)-5-methyl-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Formula: C27H24Cl2N6O MolecularWeight: 519.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)N=C(N2)C3=CC=C(C=C3)N(C)C)C4=C(C(=CC=C4)Cl)Cl)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(N2C(=N1)N=C(N2)C3=CC=C(C=C3)N(C)C)C4=C(C(=CC=C4)Cl)Cl)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H24Cl2N6O/c1-16-22(26(36)31-18-8-5-4-6-9-18)24(20-10-7-11-21(28)23(20)29)35-27(30-16)32-25(33-35)17-12-14-19(15-13-17)34(2)3/h4-15,24H,1-3H3,(H,31,36)(H,30,32,33)