[4-[(4-ethylphenoxy)methyl]thiophen-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-[(4-ethylphenoxy)methyl]thiophen-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[4-[(4-ethylphenoxy)methyl]-2-thienyl]methanone CAS Name: [4-[(4-ethylphenoxy)methyl]-2-thiophenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[4-[(4-ethylphenoxy)methyl]thiophen-2-yl]methanone Traditional Name: (4-benzylpiperazino)-[4-[(4-ethylphenoxy)methyl]-2-thienyl]methanone Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=CSC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2S/c1-2-20-8-10-23(11-9-20)29-18-22-16-24(30-19-22)25(28)27-14-12-26(13-15-27)17-21-6-4-3-5-7-21/h3-11,16,19H,2,12-15,17-18H2,1H3