ethyl 4-[1-[[4-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[[4-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[[4-(pyrrolidin-1-ylmethyl)-2-thienyl]methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[[4-(1-pyrrolidinylmethyl)-2-thiophenyl]methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[[4-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[[4-(pyrrolidinomethyl)-2-thienyl]methyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H36N4O2S MolecularWeight: 420.61184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CC(=CS3)CN4CCCC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CC(=CS3)CN4CCCC4

InChI

InChI=1S/C22H36N4O2S/c1-2-28-22(27)26-12-10-25(11-13-26)20-6-5-9-24(16-20)17-21-14-19(18-29-21)15-23-7-3-4-8-23/h14,18,20H,2-13,15-17H2,1H3