[4-[[2-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]-(5-pyrrolidin-2-ylthiophen-2-yl)methanone

Systemtic Name: [4-[[2-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]-(5-pyrrolidin-2-ylthiophen-2-yl)methanone Openeye Name: [4-[[2-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]-(5-pyrrolidin-2-yl-2-thienyl)methanone CAS Name: [4-[[2-(hydroxymethyl)phenyl]methyl]-1-piperazinyl]-[5-(2-pyrrolidinyl)-2-thiophenyl]methanone IUPAC Name: [4-[[2-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]-(5-pyrrolidin-2-ylthiophen-2-yl)methanone Traditional Name: [4-(2-methylolbenzyl)piperazino]-(5-pyrrolidin-2-yl-2-thienyl)methanone Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C2=CC=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC=C4CO

Isomeric SMILES

C1CC(NC1)C2=CC=C(S2)C(=O)N3CCN(CC3)CC4=CC=CC=C4CO

InChI

InChI=1S/C21H27N3O2S/c25-15-17-5-2-1-4-16(17)14-23-10-12-24(13-11-23)21(26)20-8-7-19(27-20)18-6-3-9-22-18/h1-2,4-5,7-8,18,22,25H,3,6,9-15H2