2-[5-(3-bromanylthiophen-2-yl)-2-oxidanylidene-azepan-1-yl]butanamide

Systemtic Name: 2-[5-(3-bromanylthiophen-2-yl)-2-oxidanylidene-azepan-1-yl]butanamide Openeye Name: 2-[5-(3-bromo-2-thienyl)-2-oxo-azepan-1-yl]butanamide CAS Name: 2-[5-(3-bromo-2-thiophenyl)-2-oxo-1-azepanyl]butanamide IUPAC Name: 2-[5-(3-bromothiophen-2-yl)-2-oxoazepan-1-yl]butanamide Traditional Name: 2-[5-(3-bromo-2-thienyl)-2-keto-azepan-1-yl]butyramide Formula: C14H19BrN2O2S MolecularWeight: 359.28186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)N1CCC(CCC1=O)C2=C(C=CS2)Br

Isomeric SMILES

CCC(C(=O)N)N1CCC(CCC1=O)C2=C(C=CS2)Br

InChI

InChI=1S/C14H19BrN2O2S/c1-2-11(14(16)19)17-7-5-9(3-4-12(17)18)13-10(15)6-8-20-13/h6,8-9,11H,2-5,7H2,1H3,(H2,16,19)