(phenylmethyl) 4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[2-[[2-(2-thienyl)ethylamino]methyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-(2-thienyl)ethylamino]methyl]phenyl]piperazine-1-carboxylic acid benzyl ester Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2CNCCC3=CC=CS3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2CNCCC3=CC=CS3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c29-25(30-20-21-7-2-1-3-8-21)28-16-14-27(15-17-28)24-11-5-4-9-22(24)19-26-13-12-23-10-6-18-31-23/h1-11,18,26H,12-17,19-20H2