methyl 4-[[4-(4-methylpiperazin-1-yl)-2-piperidin-1-yl-phenyl]carbamoyl]-1,3-oxazole-2-carboxylate

Systemtic Name: methyl 4-[[4-(4-methylpiperazin-1-yl)-2-piperidin-1-yl-phenyl]carbamoyl]-1,3-oxazole-2-carboxylate Openeye Name: methyl 4-[[4-(4-methylpiperazin-1-yl)-2-(1-piperidyl)phenyl]carbamoyl]oxazole-2-carboxylate CAS Name: 4-[[4-(4-methyl-1-piperazinyl)-2-(1-piperidinyl)anilino]-oxomethyl]-2-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[[4-(4-methylpiperazin-1-yl)-2-piperidin-1-ylphenyl]carbamoyl]-1,3-oxazole-2-carboxylate Traditional Name: 4-[[4-(4-methylpiperazino)-2-piperidino-phenyl]carbamoyl]oxazole-2-carboxylic acid methyl ester Formula: C22H29N5O4 MolecularWeight: 427.49676

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=COC(=N3)C(=O)OC)N4CCCCC4

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=COC(=N3)C(=O)OC)N4CCCCC4

InChI

InChI=1S/C22H29N5O4/c1-25-10-12-26(13-11-25)16-6-7-17(19(14-16)27-8-4-3-5-9-27)23-20(28)18-15-31-21(24-18)22(29)30-2/h6-7,14-15H,3-5,8-13H2,1-2H3,(H,23,28)