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

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

Systemtic Name:1-[1-benzothiophen-2-yl-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
Openeye Name:1-[benzothiophen-2-yl-(4-benzyloxyphenyl)methyl]-1,4-diazepane
CAS Name:1-[1-benzothiophen-2-yl-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
IUPAC Name:1-[1-benzothiophen-2-yl-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
Traditional Name:1-[benzothiophen-2-yl-(4-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=C(C=C2)OCC3=CC=CC=C3)C4=CC5=CC=CC=C5S4


Isomeric SMILES

C1CNCCN(C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC5=CC=CC=C5S4


InChI

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


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