1-[1-benzothiophen-2-yl-(3-ethoxy-4-methoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[1-benzothiophen-2-yl-(3-ethoxy-4-methoxy-phenyl)methyl]piperazine Openeye Name: 1-[benzothiophen-2-yl-(3-ethoxy-4-methoxy-phenyl)methyl]piperazine CAS Name: 1-[1-benzothiophen-2-yl-(3-ethoxy-4-methoxyphenyl)methyl]piperazine IUPAC Name: 1-[1-benzothiophen-2-yl-(3-ethoxy-4-methoxyphenyl)methyl]piperazine Traditional Name: 1-[benzothiophen-2-yl-(3-ethoxy-4-methoxy-phenyl)methyl]piperazine Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3S2)N4CCNCC4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3S2)N4CCNCC4)OC

InChI

InChI=1S/C22H26N2O2S/c1-3-26-19-14-17(8-9-18(19)25-2)22(24-12-10-23-11-13-24)21-15-16-6-4-5-7-20(16)27-21/h4-9,14-15,22-23H,3,10-13H2,1-2H3