tert-butyl 6-(4-chlorophenyl)-5-(4-methylphenyl)-3-(piperidin-1-ylcarbamoyl)pyrazine-2-carboxylate

Systemtic Name: tert-butyl 6-(4-chlorophenyl)-5-(4-methylphenyl)-3-(piperidin-1-ylcarbamoyl)pyrazine-2-carboxylate Openeye Name: tert-butyl 6-(4-chlorophenyl)-3-(1-piperidylcarbamoyl)-5-(p-tolyl)pyrazine-2-carboxylate CAS Name: 6-(4-chlorophenyl)-5-(4-methylphenyl)-3-[oxo-(1-piperidinylamino)methyl]-2-pyrazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(4-chlorophenyl)-5-(4-methylphenyl)-3-(piperidin-1-ylcarbamoyl)pyrazine-2-carboxylate Traditional Name: 6-(4-chlorophenyl)-3-(piperidinocarbamoyl)-5-(p-tolyl)pyrazinic acid tert-butyl ester Formula: C28H31ClN4O3 MolecularWeight: 507.02374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(C(=N2)C(=O)NN3CCCCC3)C(=O)OC(C)(C)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(C(=N2)C(=O)NN3CCCCC3)C(=O)OC(C)(C)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H31ClN4O3/c1-18-8-10-19(11-9-18)22-23(20-12-14-21(29)15-13-20)31-25(27(35)36-28(2,3)4)24(30-22)26(34)32-33-16-6-5-7-17-33/h8-15H,5-7,16-17H2,1-4H3,(H,32,34)