ethyl 4-[6-methyl-2-[1-[2-(phenylcarbamoylamino)ethanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-2-[1-[2-(phenylcarbamoylamino)ethanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]-4-piperidyl]pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[1-[2-[[anilino(oxo)methyl]amino]-1-oxoethyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]piperidin-4-yl]pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]-4-piperidyl]nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C28H36N6O5 MolecularWeight: 536.62264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)CNC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)CNC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H36N6O5/c1-3-39-28(38)34-17-15-33(16-18-34)26(36)23-10-9-20(2)30-25(23)21-11-13-32(14-12-21)24(35)19-29-27(37)31-22-7-5-4-6-8-22/h4-10,21H,3,11-19H2,1-2H3,(H2,29,31,37)