1-[(5-bromanylthiophen-2-yl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane Openeye Name: 1-[(5-bromo-2-thienyl)methyl]-4-(3-thienylmethyl)-1,4-diazepane CAS Name: 1-[(5-bromo-2-thiophenyl)methyl]-4-(3-thiophenylmethyl)-1,4-diazepane IUPAC Name: 1-[(5-bromothiophen-2-yl)methyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane Traditional Name: 1-[(5-bromo-2-thienyl)methyl]-4-(3-thenyl)-1,4-diazepane Formula: C15H19BrN2S2 MolecularWeight: 371.35876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=C(S2)Br)CC3=CSC=C3

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=C(S2)Br)CC3=CSC=C3

InChI

InChI=1S/C15H19BrN2S2/c16-15-3-2-14(20-15)11-18-6-1-5-17(7-8-18)10-13-4-9-19-12-13/h2-4,9,12H,1,5-8,10-11H2