1-[4-(phenylmethyl)piperazin-1-yl]-3-pyrrol-1-yl-3-thiophen-2-yl-propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-3-pyrrol-1-yl-3-thiophen-2-yl-propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-pyrrol-1-yl-3-(2-thienyl)propan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-3-(1-pyrrolyl)-3-thiophen-2-yl-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-pyrrol-1-yl-3-thiophen-2-ylpropan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-pyrrol-1-yl-3-(2-thienyl)propan-1-one Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC(C3=CC=CS3)N4C=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC(C3=CC=CS3)N4C=CC=C4

InChI

InChI=1S/C22H25N3OS/c26-22(17-20(21-9-6-16-27-21)24-10-4-5-11-24)25-14-12-23(13-15-25)18-19-7-2-1-3-8-19/h1-11,16,20H,12-15,17-18H2