methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-6-methyl-3-[3-(4-pyridin-2-ylpiperidin-1-yl)propylcarbamoyl]-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-6-methyl-3-[3-(4-pyridin-2-ylpiperidin-1-yl)propylcarbamoyl]-4H-pyrimidine-5-carboxylate Openeye Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-6-methyl-3-[3-[4-(2-pyridyl)-1-piperidyl]propylcarbamoyl]-4H-pyrimidine-5-carboxylate CAS Name: 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-6-methyl-3-[oxo-[3-[4-(2-pyridinyl)-1-piperidinyl]propylamino]methyl]-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-6-methyl-3-[3-(4-pyridin-2-ylpiperidin-1-yl)propylcarbamoyl]-4H-pyrimidine-5-carboxylate Traditional Name: 4-benzofurazan-5-yl-2-methoxy-6-methyl-3-[3-[4-(2-pyridyl)piperidino]propylcarbamoyl]-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C28H33N7O5 MolecularWeight: 547.60552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=N1)OC)C(=O)NCCCN2CCC(CC2)C3=CC=CC=N3)C4=CC5=NON=C5C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(N(C(=N1)OC)C(=O)NCCCN2CCC(CC2)C3=CC=CC=N3)C4=CC5=NON=C5C=C4)C(=O)OC

InChI

InChI=1S/C28H33N7O5/c1-18-24(26(36)38-2)25(20-8-9-22-23(17-20)33-40-32-22)35(28(31-18)39-3)27(37)30-13-6-14-34-15-10-19(11-16-34)21-7-4-5-12-29-21/h4-5,7-9,12,17,19,25H,6,10-11,13-16H2,1-3H3,(H,30,37)