1-[5-(3-bromophenyl)carbonyl-3-pyridin-4-yl-thiophen-2-yl]piperidin-4-one

Systemtic Name: 1-[5-(3-bromophenyl)carbonyl-3-pyridin-4-yl-thiophen-2-yl]piperidin-4-one Openeye Name: 1-[5-(3-bromobenzoyl)-3-(4-pyridyl)-2-thienyl]piperidin-4-one CAS Name: 1-[5-[(3-bromophenyl)-oxomethyl]-3-pyridin-4-yl-2-thiophenyl]-4-piperidinone IUPAC Name: 1-[5-(3-bromobenzoyl)-3-pyridin-4-ylthiophen-2-yl]piperidin-4-one Traditional Name: 1-[5-(3-bromobenzoyl)-3-(4-pyridyl)-2-thienyl]-4-piperidone Formula: C21H17BrN2O2S MolecularWeight: 441.34088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=C(C=C(S2)C(=O)C3=CC(=CC=C3)Br)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1=O)C2=C(C=C(S2)C(=O)C3=CC(=CC=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C21H17BrN2O2S/c22-16-3-1-2-15(12-16)20(26)19-13-18(14-4-8-23-9-5-14)21(27-19)24-10-6-17(25)7-11-24/h1-5,8-9,12-13H,6-7,10-11H2