ethyl 4-[6-methyl-2-[1-(5-methylsulfanylthiophen-2-yl)carbonylpiperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-2-[1-(5-methylsulfanylthiophen-2-yl)carbonylpiperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-2-[1-(5-methylsulfanylthiophene-2-carbonyl)-4-piperidyl]pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-methyl-2-[1-[[5-(methylthio)-2-thiophenyl]-oxomethyl]-4-piperidinyl]-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-2-[1-(5-methylsulfanylthiophene-2-carbonyl)piperidin-4-yl]pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-methyl-2-[1-[5-(methylthio)thiophene-2-carbonyl]-4-piperidyl]nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H32N4O4S2 MolecularWeight: 516.67598

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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)C4=CC=C(S4)SC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=CC=C(S4)SC

InChI

InChI=1S/C25H32N4O4S2/c1-4-33-25(32)29-15-13-28(14-16-29)23(30)19-6-5-17(2)26-22(19)18-9-11-27(12-10-18)24(31)20-7-8-21(34-3)35-20/h5-8,18H,4,9-16H2,1-3H3