1-[(2-bromophenyl)-(5-ethylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2-bromophenyl)-(5-ethylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2-bromophenyl)-(5-ethyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromophenyl)-(5-ethyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-bromophenyl)-(5-ethylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(2-bromophenyl)-(5-ethyl-2-thienyl)methyl]-1,4-diazepane Formula: C18H23BrN2S MolecularWeight: 379.35762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC=C2Br)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC=C2Br)N3CCCNCC3

InChI

InChI=1S/C18H23BrN2S/c1-2-14-8-9-17(22-14)18(15-6-3-4-7-16(15)19)21-12-5-10-20-11-13-21/h3-4,6-9,18,20H,2,5,10-13H2,1H3