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1-[1-benzothiophen-3-yl-(2-phenylmethoxyphenyl)methyl]-1,4-diazepane

1-[1-benzothiophen-3-yl-(2-phenylmethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name:1-[1-benzothiophen-3-yl-(2-phenylmethoxyphenyl)methyl]-1,4-diazepane
Openeye Name:1-[benzothiophen-3-yl-(2-benzyloxyphenyl)methyl]-1,4-diazepane
CAS Name:1-[1-benzothiophen-3-yl-(2-phenylmethoxyphenyl)methyl]-1,4-diazepane
IUPAC Name:1-[1-benzothiophen-3-yl-(2-phenylmethoxyphenyl)methyl]-1,4-diazepane
Traditional Name:1-[benzothiophen-3-yl-(2-benzoxyphenyl)methyl]-1,4-diazepane
Formula: C27H28N2OS
MolecularWeight: 428.58902
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CSC5=CC=CC=C54


Isomeric SMILES

C1CNCCN(C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CSC5=CC=CC=C54


InChI

InChI=1S/C27H28N2OS/c1-2-9-21(10-3-1)19-30-25-13-6-4-12-23(25)27(29-17-8-15-28-16-18-29)24-20-31-26-14-7-5-11-22(24)26/h1-7,9-14,20,27-28H,8,15-19H2


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