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1-[(3-methylthiophen-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

1-[(3-methylthiophen-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name:1-[(3-methylthiophen-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
Openeye Name:1-[(3-methyl-2-thienyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
CAS Name:1-[(3-methyl-2-thiophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
IUPAC Name:1-[(3-methylthiophen-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
Traditional Name:1-[(3-methyl-2-thienyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane
Formula: C18H21F3N2S
MolecularWeight: 354.43295
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3


Isomeric SMILES

CC1=C(SC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3


InChI

InChI=1S/C18H21F3N2S/c1-13-6-11-24-17(13)16(23-9-3-7-22-8-10-23)14-4-2-5-15(12-14)18(19,20)21/h2,4-6,11-12,16,22H,3,7-10H2,1H3


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