1-[(3-thiophen-3-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(3-thiophen-3-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Openeye Name: 1-[[3-(3-thienyl)phenyl]methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine CAS Name: 1-[[3-(3-thiophenyl)phenyl]methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3-thiophen-3-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Traditional Name: 1-[3-(3-thienyl)benzyl]-4-(2,3,4-trimethoxybenzyl)piperazine Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C4=CSC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C4=CSC=C4)OC)OC

InChI

InChI=1S/C25H30N2O3S/c1-28-23-8-7-21(24(29-2)25(23)30-3)17-27-12-10-26(11-13-27)16-19-5-4-6-20(15-19)22-9-14-31-18-22/h4-9,14-15,18H,10-13,16-17H2,1-3H3