ethyl 4-[6-methyl-2-[1-[4-oxidanylidene-4-(pyridin-3-ylamino)butanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-2-[1-[4-oxidanylidene-4-(pyridin-3-ylamino)butanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-2-[1-[4-oxo-4-(3-pyridylamino)butanoyl]-4-piperidyl]pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[1-[1,4-dioxo-4-(3-pyridinylamino)butyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-2-[1-[4-oxo-4-(pyridin-3-ylamino)butanoyl]piperidin-4-yl]pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[1-[4-keto-4-(3-pyridylamino)butanoyl]-4-piperidyl]-6-methyl-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)CCC(=O)NC4=CN=CC=C4

Isomeric SMILES

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

InChI

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