N-(oxolan-2-ylmethyl)-N-(5-piperazin-1-ylcarbonyl-1-pyridin-3-ylcarbonyl-pyrrolidin-3-yl)thiophene-2-carboxamide

Systemtic Name: N-(oxolan-2-ylmethyl)-N-(5-piperazin-1-ylcarbonyl-1-pyridin-3-ylcarbonyl-pyrrolidin-3-yl)thiophene-2-carboxamide Openeye Name: N-[5-(piperazine-1-carbonyl)-1-(pyridine-3-carbonyl)pyrrolidin-3-yl]-N-(tetrahydrofuran-2-ylmethyl)thiophene-2-carboxamide CAS Name: N-(2-oxolanylmethyl)-N-[5-[oxo(1-piperazinyl)methyl]-1-[oxo(3-pyridinyl)methyl]-3-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-(oxolan-2-ylmethyl)-N-[5-(piperazine-1-carbonyl)-1-(pyridine-3-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide Traditional Name: N-[1-nicotinoyl-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-(tetrahydrofurfuryl)thiophene-2-carboxamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)N4CCNCC4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CC(OC1)CN(C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)N4CCNCC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H31N5O4S/c31-23(18-4-1-7-27-15-18)30-16-19(14-21(30)24(32)28-10-8-26-9-11-28)29(17-20-5-2-12-34-20)25(33)22-6-3-13-35-22/h1,3-4,6-7,13,15,19-21,26H,2,5,8-12,14,16-17H2