1-[[3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonylphenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonylphenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[3-[4-(3-thienylmethyl)piperazine-1-carbonyl]phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[3-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[3-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[3-[4-(3-thenyl)piperazine-1-carbonyl]benzyl]-2-pyrrolidone Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C21H25N3O2S/c25-20-5-2-7-24(20)15-17-3-1-4-19(13-17)21(26)23-10-8-22(9-11-23)14-18-6-12-27-16-18/h1,3-4,6,12-13,16H,2,5,7-11,14-15H2