7-[(E)-3-thiophen-2-ylprop-2-enyl]azepan-2-amine

Systemtic Name: 7-[(E)-3-thiophen-2-ylprop-2-enyl]azepan-2-amine Openeye Name: 7-[(E)-3-(2-thienyl)allyl]azepan-2-amine CAS Name: 7-[(E)-3-thiophen-2-ylprop-2-enyl]-2-azepanamine IUPAC Name: 7-[(E)-3-thiophen-2-ylprop-2-enyl]azepan-2-amine Traditional Name: [7-[(E)-3-(2-thienyl)allyl]azepan-2-yl]amine Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NC(C1)CC=CC2=CC=CS2)N

Isomeric SMILES

C1CCC(NC(C1)C/C=C/C2=CC=CS2)N

InChI

InChI=1S/C13H20N2S/c14-13-9-2-1-5-11(15-13)6-3-7-12-8-4-10-16-12/h3-4,7-8,10-11,13,15H,1-2,5-6,9,14H2/b7-3+