3-phenyl-1-[4-(2-thiophen-3-ylpyrrolidin-1-yl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-phenyl-1-[4-(2-thiophen-3-ylpyrrolidin-1-yl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-phenyl-1-[4-[2-(3-thienyl)pyrrolidine-1-carbonyl]-1-piperidyl]propan-1-one CAS Name: 1-[4-[oxo-[2-(3-thiophenyl)-1-pyrrolidinyl]methyl]-1-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 3-phenyl-1-[4-(2-thiophen-3-ylpyrrolidine-1-carbonyl)piperidin-1-yl]propan-1-one Traditional Name: 3-phenyl-1-[4-[2-(3-thienyl)pyrrolidine-1-carbonyl]piperidino]propan-1-one Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCN(CC2)C(=O)CCC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCN(CC2)C(=O)CCC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C23H28N2O2S/c26-22(9-8-18-5-2-1-3-6-18)24-14-10-19(11-15-24)23(27)25-13-4-7-21(25)20-12-16-28-17-20/h1-3,5-6,12,16-17,19,21H,4,7-11,13-15H2