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

Systemtic Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4H-pyrimidine-5-carboxylate Openeye Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-3-[3-(4-methoxycarbonyl-4-phenyl-1-piperidyl)propylcarbamoyl]-6-methyl-4H-pyrimidine-5-carboxylate CAS Name: 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-3-[[3-(4-methoxycarbonyl-4-phenyl-1-piperidinyl)propylamino]-oxomethyl]-6-methyl-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(2,1,3-benzoxadiazol-5-yl)-2-methoxy-3-[3-(4-methoxycarbonyl-4-phenylpiperidin-1-yl)propylcarbamoyl]-6-methyl-4H-pyrimidine-5-carboxylate Traditional Name: 4-benzofurazan-5-yl-3-[3-(4-carbomethoxy-4-phenyl-piperidino)propylcarbamoyl]-2-methoxy-6-methyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C31H36N6O7 MolecularWeight: 604.65354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36N6O7/c1-20-25(27(38)41-2)26(21-11-12-23-24(19-21)35-44-34-23)37(30(33-20)43-4)29(40)32-15-8-16-36-17-13-31(14-18-36,28(39)42-3)22-9-6-5-7-10-22/h5-7,9-12,19,26H,8,13-18H2,1-4H3,(H,32,40)